COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  F   UNL     1       8.047  -1.223  -0.312  1.00  0.00           F  
HETATM    2  C   UNL     1       7.189  -0.324   0.330  1.00  0.00           C  
HETATM    3  F   UNL     1       6.974  -0.744   1.647  1.00  0.00           F  
HETATM    4  F   UNL     1       7.768   0.950   0.335  1.00  0.00           F  
HETATM    5  C   UNL     1       5.873  -0.275  -0.403  1.00  0.00           C  
HETATM    6  C   UNL     1       4.864   0.554   0.046  1.00  0.00           C  
HETATM    7  C   UNL     1       5.680  -1.056  -1.528  1.00  0.00           C  
HETATM    8  C   UNL     1       4.474  -1.013  -2.204  1.00  0.00           C  
HETATM    9  C   UNL     1       3.459  -0.191  -1.757  1.00  0.00           C  
HETATM   10  C   UNL     1       3.652   0.598  -0.630  1.00  0.00           C  
HETATM   11  N   UNL     1       2.627   1.436  -0.178  1.00  0.00           N  
HETATM   12  C   UNL     1       1.340   1.120  -0.423  1.00  0.00           C  
HETATM   13  O   UNL     1       1.065   0.060  -0.951  1.00  0.00           O  
HETATM   14  C   UNL     1       0.264   2.062  -0.050  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.073   1.690  -0.197  1.00  0.00           C  
HETATM   16  C   UNL     1       0.581   3.324   0.456  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.426   4.201   0.803  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.750   3.835   0.653  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.844   4.799   1.035  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.077   2.577   0.161  1.00  0.00           C  
HETATM   21  N   UNL     1      -3.418   2.212   0.011  1.00  0.00           N  
HETATM   22  C   UNL     1      -3.774   0.876   0.004  1.00  0.00           C  
HETATM   23  N   UNL     1      -2.880  -0.066   0.275  1.00  0.00           N  
HETATM   24  C   UNL     1      -5.097   0.484  -0.286  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.286   1.172  -0.607  1.00  0.00           C  
HETATM   26  N   UNL     1      -7.236   0.297  -0.780  1.00  0.00           N  
HETATM   27  N   UNL     1      -6.730  -0.994  -0.585  1.00  0.00           N  
HETATM   28  C   UNL     1      -7.492  -2.241  -0.693  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.405  -0.892  -0.278  1.00  0.00           C  
HETATM   30  N   UNL     1      -4.442  -1.765   0.001  1.00  0.00           N  
HETATM   31  C   UNL     1      -3.215  -1.352   0.272  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.173  -2.362   0.582  1.00  0.00           C  
HETATM   33  N   UNL     1      -2.452  -3.658   0.485  1.00  0.00           N  
HETATM   34  C   UNL     1      -1.522  -4.553   0.762  1.00  0.00           C  
HETATM   35  C   UNL     1      -0.258  -4.144   1.153  1.00  0.00           C  
HETATM   36  N   UNL     1       0.024  -2.857   1.251  1.00  0.00           N  
HETATM   37  C   UNL     1      -0.898  -1.954   0.971  1.00  0.00           C  
HETATM   38  H   UNL     1       5.017   1.166   0.923  1.00  0.00           H  
HETATM   39  H   UNL     1       6.473  -1.699  -1.880  1.00  0.00           H  
HETATM   40  H   UNL     1       4.326  -1.624  -3.082  1.00  0.00           H  
HETATM   41  H   UNL     1       2.517  -0.158  -2.285  1.00  0.00           H  
HETATM   42  H   UNL     1       2.843   2.245   0.313  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.324   0.715  -0.587  1.00  0.00           H  
HETATM   44  H   UNL     1       1.615   3.614   0.575  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.178   5.177   1.195  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.104   5.413   0.173  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.721   4.242   1.364  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.496   5.440   1.846  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.099   2.896  -0.089  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.391   2.243  -0.694  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.445  -2.608  -1.719  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.068  -2.986  -0.021  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.532  -2.056  -0.421  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.748  -5.607   0.683  1.00  0.00           H  
HETATM   55  H   UNL     1       0.500  -4.880   1.379  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.667  -0.902   1.051  1.00  0.00           H  
CONECT    1    2                                                      
CONECT    2    1    4    5    3                                       
CONECT    3    2                                                      
CONECT    4    2                                                      
CONECT    5    6    2    7    7                                       
CONECT    6   10   10    5   38                                       
CONECT    7    5    5    8   39                                       
CONECT    8    9    9    7   40                                       
CONECT    9   10    8    8   41                                       
CONECT   10   11    6    6    9                                       
CONECT   11   12   10   42                                            
CONECT   12   14   13   13   11                                       
CONECT   13   12   12                                                 
CONECT   14   15   15   16   12                                       
CONECT   15   20   14   14   43                                       
CONECT   16   17   17   14   44                                       
CONECT   17   18   16   16   45                                       
CONECT   18   19   20   20   17                                       
CONECT   19   18   46   47   48                                       
CONECT   20   21   18   18   15                                       
CONECT   21   22   20   49                                            
CONECT   22   23   21   24   24                                       
CONECT   23   31   31   22                                            
CONECT   24   22   22   29   25                                       
CONECT   25   24   26   26   50                                       
CONECT   26   25   25   27                                            
CONECT   27   29   28   26                                            
CONECT   28   27   51   52   53                                       
CONECT   29   30   30   24   27                                       
CONECT   30   31   29   29                                            
CONECT   31   32   23   23   30                                       
CONECT   32   37   37   33   31                                       
CONECT   33   34   34   32                                            
CONECT   34   35   33   33   54                                       
CONECT   35   36   36   34   55                                       
CONECT   36   35   35   37                                            
CONECT   37   36   32   32   56                                       
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   11                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   21                                                      
CONECT   50   25                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
CONECT   53   28                                                      
CONECT   54   34                                                      
CONECT   55   35                                                      
CONECT   56   37                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
