COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.101   1.067   1.113  1.00  0.00           C  
HETATM    2  N   UNL     1      -4.829   0.022   0.771  1.00  0.00           N  
HETATM    3  C   UNL     1      -4.270  -1.071   0.286  1.00  0.00           C  
HETATM    4  N   UNL     1      -2.971  -1.177   0.119  1.00  0.00           N  
HETATM    5  C   UNL     1      -2.157  -0.171   0.438  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.713   1.008   0.956  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.150  -2.236  -0.089  1.00  0.00           C  
HETATM    8  N   UNL     1      -1.908   2.086   1.303  1.00  0.00           N  
HETATM    9  C   UNL     1      -0.695  -0.296   0.248  1.00  0.00           C  
HETATM   10  O   UNL     1       0.029   0.656   0.465  1.00  0.00           O  
HETATM   11  C   UNL     1      -6.612  -1.881   0.192  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.978  -2.548  -1.576  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.754  -3.461   0.739  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.377   2.911   0.308  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.479   3.927   0.625  1.00  0.00           C  
HETATM   16  N   UNL     1       0.001   4.686  -0.346  1.00  0.00           N  
HETATM   17  C   UNL     1      -0.360   4.490  -1.599  1.00  0.00           C  
HETATM   18  N   UNL     1      -1.207   3.540  -1.940  1.00  0.00           N  
HETATM   19  C   UNL     1      -1.728   2.735  -1.029  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.166  -1.464  -0.164  1.00  0.00           N  
HETATM   21  C   UNL     1       1.205  -1.559  -0.424  1.00  0.00           C  
HETATM   22  C   UNL     1       2.109  -0.843   0.349  1.00  0.00           C  
HETATM   23  C   UNL     1       3.467  -0.939   0.089  1.00  0.00           C  
HETATM   24  C   UNL     1       3.920  -1.750  -0.942  1.00  0.00           C  
HETATM   25  C   UNL     1       3.018  -2.462  -1.711  1.00  0.00           C  
HETATM   26  C   UNL     1       1.664  -2.373  -1.452  1.00  0.00           C  
HETATM   27  O   UNL     1       4.355  -0.240   0.843  1.00  0.00           O  
HETATM   28  C   UNL     1       5.739  -0.386   0.519  1.00  0.00           C  
HETATM   29  F   UNL     1       5.956   0.029  -0.799  1.00  0.00           F  
HETATM   30  F   UNL     1       6.507   0.397   1.388  1.00  0.00           F  
HETATM   31  F   UNL     1       6.109  -1.729   0.652  1.00  0.00           F  
HETATM   32  H   UNL     1      -4.571   1.958   1.505  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.714   2.266   2.237  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.894  -1.009  -0.397  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.248  -2.724  -0.078  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.734  -1.659   1.253  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.937  -2.800  -1.776  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.614  -3.390  -1.847  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.260  -1.675  -2.166  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.877  -3.238   1.799  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.391  -4.303   0.468  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.713  -3.713   0.539  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.179   4.093   1.649  1.00  0.00           H  
HETATM   44  H   UNL     1       0.050   5.128  -2.368  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.418   1.956  -1.316  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.736  -2.240  -0.281  1.00  0.00           H  
HETATM   47  H   UNL     1       1.755  -0.212   1.151  1.00  0.00           H  
HETATM   48  H   UNL     1       4.978  -1.825  -1.145  1.00  0.00           H  
HETATM   49  H   UNL     1       3.373  -3.092  -2.513  1.00  0.00           H  
HETATM   50  H   UNL     1       0.962  -2.933  -2.051  1.00  0.00           H  
CONECT    1    2    2    6   32                                       
CONECT    2    1    1    3                                            
CONECT    3    2    4    4    7                                       
CONECT    4    3    3    5                                            
CONECT    5    4    6    6    9                                       
CONECT    6    1    5    5    8                                       
CONECT    7    3   11   12   13                                       
CONECT    8    6   14   33                                            
CONECT    9    5   10   10   20                                       
CONECT   10    9    9                                                 
CONECT   11    7   34   35   36                                       
CONECT   12    7   37   38   39                                       
CONECT   13    7   40   41   42                                       
CONECT   14    8   15   15   19                                       
CONECT   15   14   14   16   43                                       
CONECT   16   15   17   17                                            
CONECT   17   16   16   18   44                                       
CONECT   18   17   19   19                                            
CONECT   19   14   18   18   45                                       
CONECT   20    9   21   46                                            
CONECT   21   20   22   22   26                                       
CONECT   22   21   21   23   47                                       
CONECT   23   22   24   24   27                                       
CONECT   24   23   23   25   48                                       
CONECT   25   24   26   26   49                                       
CONECT   26   21   25   25   50                                       
CONECT   27   23   28                                                 
CONECT   28   27   29   30   31                                       
CONECT   29   28                                                      
CONECT   30   28                                                      
CONECT   31   28                                                      
CONECT   32    1                                                      
CONECT   33    8                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   15                                                      
CONECT   44   17                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   22                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
