COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.175   0.857  -0.030  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.230  -0.062   0.051  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.577   0.348   0.036  1.00  0.00           C  
HETATM    4  N   UNL     1      -8.514  -0.572   0.115  1.00  0.00           N  
HETATM    5  C   UNL     1      -8.214  -1.866   0.208  1.00  0.00           C  
HETATM    6  N   UNL     1      -9.246  -2.783   0.288  1.00  0.00           N  
HETATM    7  N   UNL     1      -6.971  -2.309   0.226  1.00  0.00           N  
HETATM    8  C   UNL     1      -5.948  -1.449   0.151  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.614  -1.886   0.168  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.603  -0.980   0.089  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.872   0.394  -0.016  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.748   1.359  -0.100  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.435   0.901  -0.076  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.007   2.725  -0.210  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.965   3.626  -0.295  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.655   3.180  -0.272  1.00  0.00           C  
HETATM   17  F   UNL     1       0.361   4.067  -0.355  1.00  0.00           F  
HETATM   18  C   UNL     1      -0.383   1.813  -0.156  1.00  0.00           C  
HETATM   19  C   UNL     1       1.015   1.336  -0.131  1.00  0.00           C  
HETATM   20  O   UNL     1       1.930   2.131  -0.210  1.00  0.00           O  
HETATM   21  N   UNL     1       1.275   0.018  -0.020  1.00  0.00           N  
HETATM   22  C   UNL     1       2.593  -0.444  -0.093  1.00  0.00           C  
HETATM   23  C   UNL     1       3.626   0.319   0.432  1.00  0.00           C  
HETATM   24  C   UNL     1       2.869  -1.669  -0.686  1.00  0.00           C  
HETATM   25  C   UNL     1       4.170  -2.129  -0.750  1.00  0.00           C  
HETATM   26  C   UNL     1       5.202  -1.370  -0.230  1.00  0.00           C  
HETATM   27  C   UNL     1       4.933  -0.140   0.356  1.00  0.00           C  
HETATM   28  N   UNL     1       5.976   0.629   0.881  1.00  0.00           N  
HETATM   29  C   UNL     1       7.255   0.351   0.577  1.00  0.00           C  
HETATM   30  O   UNL     1       8.149   0.965   1.121  1.00  0.00           O  
HETATM   31  C   UNL     1       7.588  -0.715  -0.433  1.00  0.00           C  
HETATM   32  C   UNL     1       6.616  -1.887  -0.285  1.00  0.00           C  
HETATM   33  C   UNL     1       6.766  -2.832  -1.479  1.00  0.00           C  
HETATM   34  C   UNL     1       6.931  -2.646   1.006  1.00  0.00           C  
HETATM   35  H   UNL     1      -5.378   1.915  -0.106  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.835   1.394  -0.039  1.00  0.00           H  
HETATM   37  H   UNL     1     -10.167  -2.479   0.275  1.00  0.00           H  
HETATM   38  H   UNL     1      -9.049  -3.731   0.356  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.391  -2.940   0.243  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.579  -1.323   0.102  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.231  -0.156   0.005  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.028   3.079  -0.229  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.173   4.682  -0.380  1.00  0.00           H  
HETATM   44  H   UNL     1       0.547  -0.611   0.111  1.00  0.00           H  
HETATM   45  H   UNL     1       3.413   1.270   0.898  1.00  0.00           H  
HETATM   46  H   UNL     1       2.066  -2.264  -1.097  1.00  0.00           H  
HETATM   47  H   UNL     1       4.382  -3.083  -1.208  1.00  0.00           H  
HETATM   48  H   UNL     1       5.774   1.372   1.471  1.00  0.00           H  
HETATM   49  H   UNL     1       7.507  -0.301  -1.438  1.00  0.00           H  
HETATM   50  H   UNL     1       8.606  -1.067  -0.266  1.00  0.00           H  
HETATM   51  H   UNL     1       6.540  -2.294  -2.399  1.00  0.00           H  
HETATM   52  H   UNL     1       7.789  -3.207  -1.519  1.00  0.00           H  
HETATM   53  H   UNL     1       6.077  -3.669  -1.369  1.00  0.00           H  
HETATM   54  H   UNL     1       6.241  -3.483   1.113  1.00  0.00           H  
HETATM   55  H   UNL     1       7.954  -3.021   0.967  1.00  0.00           H  
HETATM   56  H   UNL     1       6.822  -1.974   1.858  1.00  0.00           H  
CONECT    1   11   11    2   35                                       
CONECT    2    8    1    3    3                                       
CONECT    3    2    2    4   36                                       
CONECT    4    5    5    3                                            
CONECT    5    7    6    4    4                                       
CONECT    6    5   37   38                                            
CONECT    7    8    8    5                                            
CONECT    8    9    7    7    2                                       
CONECT    9   10   10    8   39                                       
CONECT   10    9    9   11   40                                       
CONECT   11   10   12    1    1                                       
CONECT   12   14   13   13   11                                       
CONECT   13   12   12   18   41                                       
CONECT   14   15   15   12   42                                       
CONECT   15   14   14   16   43                                       
CONECT   16   15   17   18   18                                       
CONECT   17   16                                                      
CONECT   18   16   16   13   19                                       
CONECT   19   20   20   18   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   22   44                                            
CONECT   22   24   21   23   23                                       
CONECT   23   22   22   27   45                                       
CONECT   24   25   25   22   46                                       
CONECT   25   24   24   26   47                                       
CONECT   26   25   32   27   27                                       
CONECT   27   26   26   23   28                                       
CONECT   28   27   29   48                                            
CONECT   29   31   28   30   30                                       
CONECT   30   29   29                                                 
CONECT   31   32   29   49   50                                       
CONECT   32   34   26   31   33                                       
CONECT   33   32   51   52   53                                       
CONECT   34   32   54   55   56                                       
CONECT   35    1                                                      
CONECT   36    3                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   21                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   28                                                      
CONECT   49   31                                                      
CONECT   50   31                                                      
CONECT   51   33                                                      
CONECT   52   33                                                      
CONECT   53   33                                                      
CONECT   54   34                                                      
CONECT   55   34                                                      
CONECT   56   34                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
