COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.985   0.444   0.003  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.191   1.904   0.060  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.151   1.560   1.666  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.102   3.746   0.928  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.611  -0.235  -0.968  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.476  -1.720  -1.136  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.326  -2.339  -0.307  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.533  -4.479   0.248  1.00  0.00           C  
HETATM    9  F   UNL     1       1.650  -4.017  -1.461  1.00  0.00           F  
HETATM   10  C   UNL     1       0.584  -4.613  -0.909  1.00  0.00           C  
HETATM   11  C   UNL     1       0.488  -6.004  -0.923  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.618  -6.633  -0.351  1.00  0.00           C  
HETATM   13  F   UNL     1      -0.709  -7.970  -0.365  1.00  0.00           F  
HETATM   14  C   UNL     1      -1.628  -5.871   0.234  1.00  0.00           C  
HETATM   15  F   UNL     1      -2.690  -6.475   0.784  1.00  0.00           F  
HETATM   16  C   UNL     1      -0.427  -3.857  -0.323  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.289  -1.723   1.115  1.00  0.00           C  
HETATM   18  N   UNL     1       0.791  -2.300   1.921  1.00  0.00           N  
HETATM   19  C   UNL     1      -0.108  -0.194   1.038  1.00  0.00           C  
HETATM   20  O   UNL     1      -0.418   2.618  -0.581  1.00  0.00           O  
HETATM   21  N   UNL     1      -2.253   2.377   0.827  1.00  0.00           N  
HETATM   22  C   UNL     1      -2.492   3.828   0.894  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.950   4.114   0.843  1.00  0.00           C  
HETATM   24  N   UNL     1      -4.561   5.268   0.670  1.00  0.00           N  
HETATM   25  N   UNL     1      -5.924   5.033   0.723  1.00  0.00           N  
HETATM   26  C   UNL     1      -7.387   3.035   1.046  1.00  0.00           C  
HETATM   27  F   UNL     1      -8.493   3.840   0.921  1.00  0.00           F  
HETATM   28  F   UNL     1      -7.576   2.051   0.106  1.00  0.00           F  
HETATM   29  F   UNL     1      -7.550   2.401   2.252  1.00  0.00           F  
HETATM   30  N   UNL     1      -4.895   3.139   1.011  1.00  0.00           N  
HETATM   31  C   UNL     1      -4.595   1.736   1.202  1.00  0.00           C  
HETATM   32  H   UNL     1      -3.029   1.907   2.700  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.872   0.503   1.639  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.253   0.283  -1.676  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.434  -2.182  -0.862  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.313  -1.946  -2.197  1.00  0.00           H  
HETATM   37  H   UNL     1       0.622  -2.103  -0.811  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.325  -3.894   0.707  1.00  0.00           H  
HETATM   39  H   UNL     1       1.275  -6.598  -1.379  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.236  -1.947   1.625  1.00  0.00           H  
HETATM   41  H   UNL     1       1.598  -2.632   1.445  1.00  0.00           H  
HETATM   42  H   UNL     1       0.594  -2.521   2.870  1.00  0.00           H  
HETATM   43  H   UNL     1       0.935   0.053   0.796  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.318   0.241   2.024  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.977   4.341   0.075  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.072   4.186   1.840  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.756   1.249   0.234  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.298   1.326   1.933  1.00  0.00           H  
CONECT    1    5    5    2   19                                       
CONECT    2    1   21   20   20                                       
CONECT    3   31   21   32   33                                       
CONECT    4   26   30   25   25                                       
CONECT    5    1    1    6   34                                       
CONECT    6    5    7   35   36                                       
CONECT    7    6   16   17   37                                       
CONECT    8   14   16   16   38                                       
CONECT    9   10                                                      
CONECT   10    9   11   11   16                                       
CONECT   11   10   10   12   39                                       
CONECT   12   11   13   14   14                                       
CONECT   13   12                                                      
CONECT   14    8   12   12   15                                       
CONECT   15   14                                                      
CONECT   16    7    8    8   10                                       
CONECT   17    7   18   19   40                                       
CONECT   18   17   41   42                                            
CONECT   19    1   17   43   44                                       
CONECT   20    2    2                                                 
CONECT   21    2    3   22                                            
CONECT   22   21   23   45   46                                       
CONECT   23   22   30   24   24                                       
CONECT   24   23   23   25                                            
CONECT   25    4    4   24                                            
CONECT   26    4   27   28   29                                       
CONECT   27   26                                                      
CONECT   28   26                                                      
CONECT   29   26                                                      
CONECT   30    4   23   31                                            
CONECT   31    3   30   47   48                                       
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39   11                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   19                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   31                                                      
CONECT   48   31                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
