COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.007  -3.125   0.231  1.00  0.00           C  
HETATM    2  C   UNL     1       2.661   0.114  -0.238  1.00  0.00           C  
HETATM    3  C   UNL     1       3.215  -1.147  -0.314  1.00  0.00           C  
HETATM    4  C   UNL     1       4.656  -1.316  -0.548  1.00  0.00           C  
HETATM    5  C   UNL     1       2.340  -2.321  -0.159  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.064   3.434  -1.045  1.00  0.00           C  
HETATM    7  C   UNL     1       0.867   1.615   0.037  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.891  -0.485   0.349  1.00  0.00           C  
HETATM    9  C   UNL     1       0.459  -0.737   0.131  1.00  0.00           C  
HETATM   10  C   UNL     1       0.877   2.294   1.249  1.00  0.00           C  
HETATM   11  N   UNL     1      -0.541   4.005  -2.222  1.00  0.00           N  
HETATM   12  N   UNL     1       0.403   2.196  -1.060  1.00  0.00           N  
HETATM   13  N   UNL     1       1.350   0.306  -0.026  1.00  0.00           N  
HETATM   14  O   UNL     1       5.370  -0.340  -0.676  1.00  0.00           O  
HETATM   15  O   UNL     1       5.187  -2.553  -0.620  1.00  0.00           O  
HETATM   16  O   UNL     1       2.783  -3.455  -0.219  1.00  0.00           O  
HETATM   17  C   UNL     1       0.908  -2.069   0.072  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.317  -2.862   0.444  1.00  0.00           C  
HETATM   19  F   UNL     1      -2.188  -3.883   0.598  1.00  0.00           F  
HETATM   20  C   UNL     1      -1.773  -1.543   0.505  1.00  0.00           C  
HETATM   21  N   UNL     1      -3.126  -1.289   0.724  1.00  0.00           N  
HETATM   22  C   UNL     1      -3.651  -0.333  -0.268  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.916  -1.199  -0.351  1.00  0.00           C  
HETATM   24  O   UNL     1      -5.432  -1.356  -1.674  1.00  0.00           O  
HETATM   25  C   UNL     1      -3.967  -2.322   0.091  1.00  0.00           C  
HETATM   26 CL   UNL     1      -1.470   1.150   0.427  1.00  0.00          Cl  
HETATM   27  F   UNL     1       1.352   1.696   2.363  1.00  0.00           F  
HETATM   28  C   UNL     1       0.400   3.597   1.301  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.078   4.174   0.135  1.00  0.00           C  
HETATM   30  F   UNL     1      -0.550   5.439   0.142  1.00  0.00           F  
HETATM   31  H   UNL     1       0.355  -4.146   0.181  1.00  0.00           H  
HETATM   32  H   UNL     1       3.304   0.975  -0.353  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.464   3.524  -3.061  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.952   4.883  -2.203  1.00  0.00           H  
HETATM   35  H   UNL     1       6.139  -2.614  -0.775  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.832   0.662   0.141  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.079  -0.310  -1.195  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.681  -0.943   0.382  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.228  -1.902  -1.723  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.479  -2.830  -0.740  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.415  -3.014   0.804  1.00  0.00           H  
HETATM   42  H   UNL     1       0.397   4.147   2.230  1.00  0.00           H  
CONECT    1   18   18   17   31                                       
CONECT    2    3    3   13   32                                       
CONECT    3    5    4    2    2                                       
CONECT    4   14   14    3   15                                       
CONECT    5   16   16   17    3                                       
CONECT    6   12   12   29   11                                       
CONECT    7   13   10   10   12                                       
CONECT    8   20   20    9   26                                       
CONECT    9   17   17    8   13                                       
CONECT   10   27    7    7   28                                       
CONECT   11    6   33   34                                            
CONECT   12    7    6    6                                            
CONECT   13    9    2    7                                            
CONECT   14    4    4                                                 
CONECT   15    4   35                                                 
CONECT   16    5    5                                                 
CONECT   17    1    5    9    9                                       
CONECT   18   19    1    1   20                                       
CONECT   19   18                                                      
CONECT   20   18   21    8    8                                       
CONECT   21   20   25   22                                            
CONECT   22   21   23   36   37                                       
CONECT   23   25   22   24   38                                       
CONECT   24   23   39                                                 
CONECT   25   21   23   40   41                                       
CONECT   26    8                                                      
CONECT   27   10                                                      
CONECT   28   10   29   29   42                                       
CONECT   29   28   28    6   30                                       
CONECT   30   29                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   15                                                      
CONECT   36   22                                                      
CONECT   37   22                                                      
CONECT   38   23                                                      
CONECT   39   24                                                      
CONECT   40   25                                                      
CONECT   41   25                                                      
CONECT   42   28                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
