COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.951  -0.445  -4.271  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.626  -0.564  -2.926  1.00  0.00           C  
HETATM    3  C   UNL     1       0.660  -0.266  -2.497  1.00  0.00           C  
HETATM    4  C   UNL     1       1.611   0.151  -3.407  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.589  -0.497  -0.751  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.380  -0.541   1.493  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.636  -1.419   2.538  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.577  -0.973   3.844  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.261   0.350   4.112  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.010   1.229   3.068  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.064   0.783   1.762  1.00  0.00           C  
HETATM   12  O   UNL     1      -2.202   0.787   5.398  1.00  0.00           O  
HETATM   13  C   UNL     1      -0.492   1.191   7.020  1.00  0.00           C  
HETATM   14  C   UNL     1       0.838   1.088   7.379  1.00  0.00           C  
HETATM   15  C   UNL     1       1.371   0.058   5.381  1.00  0.00           C  
HETATM   16  C   UNL     1       0.050   0.125   4.949  1.00  0.00           C  
HETATM   17  N   UNL     1       3.680  -0.621   4.920  1.00  0.00           N  
HETATM   18  C   UNL     1       4.697  -1.226   4.056  1.00  0.00           C  
HETATM   19  C   UNL     1       1.282   0.274  -4.746  1.00  0.00           C  
HETATM   20  C   UNL     1       0.001  -0.021  -5.176  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.352   0.112  -6.635  1.00  0.00           C  
HETATM   22  F   UNL     1      -0.156   1.436  -7.042  1.00  0.00           F  
HETATM   23  F   UNL     1       0.462  -0.733  -7.393  1.00  0.00           F  
HETATM   24  F   UNL     1      -1.693  -0.239  -6.823  1.00  0.00           F  
HETATM   25 CL   UNL     1       2.480   0.799  -5.887  1.00  0.00          Cl  
HETATM   26  N   UNL     1      -1.592  -0.988  -2.006  1.00  0.00           N  
HETATM   27  N   UNL     1      -2.440  -0.992   0.168  1.00  0.00           N  
HETATM   28  O   UNL     1      -0.817   0.393  -0.449  1.00  0.00           O  
HETATM   29  C   UNL     1      -0.903   0.703   5.782  1.00  0.00           C  
HETATM   30  N   UNL     1       1.717   0.533   6.572  1.00  0.00           N  
HETATM   31  C   UNL     1       2.399  -0.553   4.507  1.00  0.00           C  
HETATM   32  O   UNL     1       2.088  -0.993   3.418  1.00  0.00           O  
HETATM   33  H   UNL     1      -1.951  -0.676  -4.607  1.00  0.00           H  
HETATM   34  H   UNL     1       0.916  -0.361  -1.452  1.00  0.00           H  
HETATM   35  H   UNL     1       2.611   0.383  -3.073  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.882  -2.449   2.329  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.777  -1.656   4.657  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.764   2.259   3.278  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.864   1.467   0.950  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.206   1.646   7.691  1.00  0.00           H  
HETATM   41  H   UNL     1       1.161   1.466   8.338  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.229  -0.263   3.981  1.00  0.00           H  
HETATM   43  H   UNL     1       3.929  -0.269   5.789  1.00  0.00           H  
HETATM   44  H   UNL     1       5.666  -1.191   4.555  1.00  0.00           H  
HETATM   45  H   UNL     1       4.431  -2.263   3.853  1.00  0.00           H  
HETATM   46  H   UNL     1       4.752  -0.673   3.118  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.263  -1.636  -2.271  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.095  -1.660  -0.086  1.00  0.00           H  
CONECT    1    2    2   20   33                                       
CONECT    2    1    1    3   26                                       
CONECT    3    2    4    4   34                                       
CONECT    4    3    3   19   35                                       
CONECT    5   26   27   28   28                                       
CONECT    6    7    7   11   27                                       
CONECT    7    6    6    8   36                                       
CONECT    8    7    9    9   37                                       
CONECT    9    8    8   10   12                                       
CONECT   10    9   11   11   38                                       
CONECT   11    6   10   10   39                                       
CONECT   12    9   29                                                 
CONECT   13   14   14   29   40                                       
CONECT   14   13   13   30   41                                       
CONECT   15   16   30   30   31                                       
CONECT   16   15   29   29   42                                       
CONECT   17   18   31   43                                            
CONECT   18   17   44   45   46                                       
CONECT   19    4   20   20   25                                       
CONECT   20    1   19   19   21                                       
CONECT   21   20   22   23   24                                       
CONECT   22   21                                                      
CONECT   23   21                                                      
CONECT   24   21                                                      
CONECT   25   19                                                      
CONECT   26    2    5   47                                            
CONECT   27    5    6   48                                            
CONECT   28    5    5                                                 
CONECT   29   12   13   16   16                                       
CONECT   30   14   15   15                                            
CONECT   31   15   17   32   32                                       
CONECT   32   31   31                                                 
CONECT   33    1                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
