COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.271   2.914  -0.203  1.00  0.00           C  
HETATM    2  N   UNL     1      -4.119   1.460  -0.105  1.00  0.00           N  
HETATM    3  C   UNL     1      -2.854   0.898  -0.048  1.00  0.00           C  
HETATM    4  N   UNL     1      -1.771   1.669  -0.076  1.00  0.00           N  
HETATM    5  C   UNL     1      -0.561   1.135  -0.022  1.00  0.00           C  
HETATM    6  N   UNL     1       0.546   1.966  -0.054  1.00  0.00           N  
HETATM    7  C   UNL     1       1.841   1.416   0.003  1.00  0.00           C  
HETATM    8  N   UNL     1       3.500  -0.011   0.116  1.00  0.00           N  
HETATM    9  C   UNL     1       2.146   0.096   0.084  1.00  0.00           C  
HETATM   10  N   UNL     1       4.035   1.282   0.049  1.00  0.00           N  
HETATM   11  C   UNL     1       3.045   2.135  -0.020  1.00  0.00           C  
HETATM   12  N   UNL     1       3.270  -3.008  -1.451  1.00  0.00           N  
HETATM   13  C   UNL     1       3.176   3.634  -0.110  1.00  0.00           C  
HETATM   14  N   UNL     1      -0.382  -0.176   0.063  1.00  0.00           N  
HETATM   15  C   UNL     1       4.266  -1.257   0.205  1.00  0.00           C  
HETATM   16  C   UNL     1       5.727  -0.985  -0.157  1.00  0.00           C  
HETATM   17  C   UNL     1       4.187  -1.802   1.632  1.00  0.00           C  
HETATM   18  C   UNL     1       3.704  -2.245  -0.730  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.417  -1.003   0.096  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.697  -0.486   0.047  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.897  -1.396   0.089  1.00  0.00           C  
HETATM   22  F   UNL     1      -3.471  -2.726   0.183  1.00  0.00           F  
HETATM   23  F   UNL     1      -4.685  -1.079   1.200  1.00  0.00           F  
HETATM   24  F   UNL     1      -4.650  -1.230  -1.079  1.00  0.00           F  
HETATM   25  H   UNL     1      -3.784   3.269  -1.111  1.00  0.00           H  
HETATM   26  H   UNL     1      -5.331   3.167  -0.237  1.00  0.00           H  
HETATM   27  H   UNL     1      -3.812   3.387   0.665  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.904   0.891  -0.079  1.00  0.00           H  
HETATM   29  H   UNL     1       0.429   2.927  -0.115  1.00  0.00           H  
HETATM   30  H   UNL     1       1.441  -0.721   0.117  1.00  0.00           H  
HETATM   31  H   UNL     1       3.190   4.058   0.894  1.00  0.00           H  
HETATM   32  H   UNL     1       4.103   3.887  -0.624  1.00  0.00           H  
HETATM   33  H   UNL     1       2.330   4.040  -0.664  1.00  0.00           H  
HETATM   34  H   UNL     1       6.143  -0.253   0.535  1.00  0.00           H  
HETATM   35  H   UNL     1       6.296  -1.912  -0.091  1.00  0.00           H  
HETATM   36  H   UNL     1       5.782  -0.596  -1.174  1.00  0.00           H  
HETATM   37  H   UNL     1       3.146  -1.996   1.891  1.00  0.00           H  
HETATM   38  H   UNL     1       4.757  -2.730   1.699  1.00  0.00           H  
HETATM   39  H   UNL     1       4.603  -1.070   2.325  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.261  -2.069   0.164  1.00  0.00           H  
CONECT    1    2   25   26   27                                       
CONECT    2    1    3   28                                            
CONECT    3    2   20   20    4                                       
CONECT    4    3    5    5                                            
CONECT    5    4    4   14    6                                       
CONECT    6    5    7   29                                            
CONECT    7    9    9    6   11                                       
CONECT    8   15    9   10                                            
CONECT    9    8    7    7   30                                       
CONECT   10    8   11   11                                            
CONECT   11    7   10   10   13                                       
CONECT   12   18   18   18                                            
CONECT   13   11   31   32   33                                       
CONECT   14   19   19    5                                            
CONECT   15   16   17    8   18                                       
CONECT   16   15   34   35   36                                       
CONECT   17   15   37   38   39                                       
CONECT   18   15   12   12   12                                       
CONECT   19   20   14   14   40                                       
CONECT   20   21    3    3   19                                       
CONECT   21   24   22   23   20                                       
CONECT   22   21                                                      
CONECT   23   21                                                      
CONECT   24   21                                                      
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    6                                                      
CONECT   30    9                                                      
CONECT   31   13                                                      
CONECT   32   13                                                      
CONECT   33   13                                                      
CONECT   34   16                                                      
CONECT   35   16                                                      
CONECT   36   16                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   19                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
