COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.620   0.699   0.860  1.00  0.00           C  
HETATM    2  C   UNL     1       7.074   0.279  -0.505  1.00  0.00           C  
HETATM    3  C   UNL     1       4.584   0.100  -0.296  1.00  0.00           C  
HETATM    4  C   UNL     1       5.688  -1.806  -0.156  1.00  0.00           C  
HETATM    5  C   UNL     1       2.316  -0.777  -0.023  1.00  0.00           C  
HETATM    6  O   UNL     1      -0.068   1.838  -0.151  1.00  0.00           O  
HETATM    7  C   UNL     1       0.852   2.914  -0.345  1.00  0.00           C  
HETATM    8  C   UNL     1       1.074   3.131  -1.843  1.00  0.00           C  
HETATM    9  C   UNL     1       0.283   4.191   0.277  1.00  0.00           C  
HETATM   10  C   UNL     1       0.161  -1.788   0.251  1.00  0.00           C  
HETATM   11  C   UNL     1       1.533  -1.916   0.163  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.571  -1.053   1.880  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.676  -1.101   3.091  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.929  -0.867   2.023  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.254  -0.942  -0.264  1.00  0.00           C  
HETATM   16  C   UNL     1      -8.493  -0.686  -1.017  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.899  -1.131  -0.491  1.00  0.00           C  
HETATM   18  N   UNL     1       5.815  -0.449  -0.325  1.00  0.00           N  
HETATM   19  O   UNL     1       4.318   1.282  -0.418  1.00  0.00           O  
HETATM   20  N   UNL     1       3.699  -0.903  -0.112  1.00  0.00           N  
HETATM   21  N   UNL     1       4.432  -2.095  -0.028  1.00  0.00           N  
HETATM   22  C   UNL     1       6.823  -2.796  -0.127  1.00  0.00           C  
HETATM   23  O   UNL     1       6.302  -4.113   0.066  1.00  0.00           O  
HETATM   24  N   UNL     1       1.763   0.422  -0.122  1.00  0.00           N  
HETATM   25  C   UNL     1       0.454   0.593  -0.044  1.00  0.00           C  
HETATM   26  F   UNL     1       1.184   5.244   0.087  1.00  0.00           F  
HETATM   27  F   UNL     1      -0.936   4.504  -0.334  1.00  0.00           F  
HETATM   28  F   UNL     1       0.080   3.992   1.647  1.00  0.00           F  
HETATM   29  C   UNL     1      -0.397  -0.505   0.148  1.00  0.00           C  
HETATM   30  F   UNL     1       2.112  -3.133   0.257  1.00  0.00           F  
HETATM   31  C   UNL     1      -1.855  -0.315   0.235  1.00  0.00           C  
HETATM   32  O   UNL     1      -2.329   0.801   0.144  1.00  0.00           O  
HETATM   33  N   UNL     1      -2.664  -1.378   0.414  1.00  0.00           N  
HETATM   34  C   UNL     1      -4.034  -1.189   0.599  1.00  0.00           C  
HETATM   35  N   UNL     1      -6.722  -0.817   0.968  1.00  0.00           N  
HETATM   36  O   UNL     1      -7.109  -0.883  -1.316  1.00  0.00           O  
HETATM   37 CL   UNL     1      -4.291  -1.295  -2.108  1.00  0.00          Cl  
HETATM   38  H   UNL     1       8.557   1.240   0.726  1.00  0.00           H  
HETATM   39  H   UNL     1       6.896   1.344   1.359  1.00  0.00           H  
HETATM   40  H   UNL     1       7.797  -0.187   1.470  1.00  0.00           H  
HETATM   41  H   UNL     1       6.897   1.166  -1.114  1.00  0.00           H  
HETATM   42  H   UNL     1       7.798  -0.366  -1.004  1.00  0.00           H  
HETATM   43  H   UNL     1       1.802   2.670   0.132  1.00  0.00           H  
HETATM   44  H   UNL     1       0.125   3.375  -2.319  1.00  0.00           H  
HETATM   45  H   UNL     1       1.776   3.952  -1.991  1.00  0.00           H  
HETATM   46  H   UNL     1       1.480   2.221  -2.286  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.467  -2.655   0.395  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.594  -2.131   3.440  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.687  -0.727   2.828  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.101  -0.482   3.881  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.351  -0.761   3.011  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.851  -1.506  -0.394  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.619   0.256  -0.485  1.00  0.00           H  
HETATM   54  H   UNL     1      -9.065  -0.659  -1.945  1.00  0.00           H  
HETATM   55  H   UNL     1       7.365  -2.755  -1.071  1.00  0.00           H  
HETATM   56  H   UNL     1       7.499  -2.549   0.691  1.00  0.00           H  
HETATM   57  H   UNL     1       6.978  -4.803   0.095  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.293  -2.275   0.416  1.00  0.00           H  
CONECT    1    2   38   39   40                                       
CONECT    2    1   18   41   42                                       
CONECT    3   19   19   18   20                                       
CONECT    4   18   21   21   22                                       
CONECT    5   11   20   24   24                                       
CONECT    6   25    7                                                 
CONECT    7    6    9    8   43                                       
CONECT    8    7   44   45   46                                       
CONECT    9   26    7   28   27                                       
CONECT   10   11   11   29   47                                       
CONECT   11   30   10   10    5                                       
CONECT   12   13   14   14   34                                       
CONECT   13   12   48   49   50                                       
CONECT   14   12   12   35   51                                       
CONECT   15   35   35   17   36                                       
CONECT   16   36   52   53   54                                       
CONECT   17   34   34   15   37                                       
CONECT   18    3    2    4                                            
CONECT   19    3    3                                                 
CONECT   20    3    5   21                                            
CONECT   21   20    4    4                                            
CONECT   22    4   23   55   56                                       
CONECT   23   22   57                                                 
CONECT   24    5    5   25                                            
CONECT   25   29   29   24    6                                       
CONECT   26    9                                                      
CONECT   27    9                                                      
CONECT   28    9                                                      
CONECT   29   10   31   25   25                                       
CONECT   30   11                                                      
CONECT   31   32   32   29   33                                       
CONECT   32   31   31                                                 
CONECT   33   31   34   58                                            
CONECT   34   12   33   17   17                                       
CONECT   35   14   15   15                                            
CONECT   36   15   16                                                 
CONECT   37   17                                                      
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    2                                                      
CONECT   42    2                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    8                                                      
CONECT   47   10                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   16                                                      
CONECT   55   22                                                      
CONECT   56   22                                                      
CONECT   57   23                                                      
CONECT   58   33                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
