COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.405   0.381  -0.210  1.00  0.00           C  
HETATM    2  C   UNL     1       4.290  -1.325   0.317  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.227   1.364   0.648  1.00  0.00           C  
HETATM    4  C   UNL     1       0.617   1.524   0.220  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.811  -0.758   0.045  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.174   0.297   0.609  1.00  0.00           C  
HETATM    7  F   UNL     1       4.881   1.969  -1.086  1.00  0.00           F  
HETATM    8  C   UNL     1       5.112   0.763  -0.523  1.00  0.00           C  
HETATM    9  C   UNL     1       4.054  -0.091  -0.259  1.00  0.00           C  
HETATM   10  C   UNL     1       5.584  -1.711   0.620  1.00  0.00           C  
HETATM   11  F   UNL     1       5.815  -2.920   1.178  1.00  0.00           F  
HETATM   12  C   UNL     1       6.641  -0.855   0.361  1.00  0.00           C  
HETATM   13  C   UNL     1       2.647   0.325  -0.600  1.00  0.00           C  
HETATM   14  C   UNL     1       2.068   1.156   0.548  1.00  0.00           C  
HETATM   15  N   UNL     1       2.859   2.382   0.714  1.00  0.00           N  
HETATM   16  O   UNL     1       1.840  -0.839  -0.797  1.00  0.00           O  
HETATM   17  C   UNL     1       0.485  -0.556  -1.152  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.180   0.240  -0.027  1.00  0.00           C  
HETATM   19  N   UNL     1      -1.555   0.583  -0.415  1.00  0.00           N  
HETATM   20  C   UNL     1      -2.389  -0.634  -0.545  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.686   0.968   0.587  1.00  0.00           C  
HETATM   22  N   UNL     1      -4.893   1.335   0.959  1.00  0.00           N  
HETATM   23  N   UNL     1      -5.817   0.391   0.499  1.00  0.00           N  
HETATM   24  C   UNL     1      -5.120  -0.579  -0.176  1.00  0.00           C  
HETATM   25  C   UNL     1      -3.780  -0.222  -0.124  1.00  0.00           C  
HETATM   26  N   UNL     1      -5.761  -1.618  -0.729  1.00  0.00           N  
HETATM   27  C   UNL     1      -7.065  -1.729  -0.637  1.00  0.00           C  
HETATM   28  H   UNL     1       7.230   1.046  -0.417  1.00  0.00           H  
HETATM   29  H   UNL     1       3.465  -1.991   0.523  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.809   1.111   1.622  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.119   2.431   0.456  1.00  0.00           H  
HETATM   32  H   UNL     1       0.181   2.069   1.058  1.00  0.00           H  
HETATM   33  H   UNL     1       0.590   2.148  -0.673  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.885  -0.849   0.120  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.734   1.055   1.138  1.00  0.00           H  
HETATM   36  H   UNL     1       7.651  -1.157   0.597  1.00  0.00           H  
HETATM   37  H   UNL     1       2.655   0.921  -1.513  1.00  0.00           H  
HETATM   38  H   UNL     1       2.097   0.575   1.469  1.00  0.00           H  
HETATM   39  H   UNL     1       3.821   2.165   0.931  1.00  0.00           H  
HETATM   40  H   UNL     1       2.797   2.967  -0.106  1.00  0.00           H  
HETATM   41  H   UNL     1       0.465   0.028  -2.072  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.053  -1.492  -1.304  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.198  -0.359   0.883  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.395  -0.977  -1.580  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.565  -2.573  -1.089  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.013  -1.420   0.110  1.00  0.00           H  
CONECT    1   12    8    8   28                                       
CONECT    2   10    9    9   29                                       
CONECT    3   21   19   30   31                                       
CONECT    4   14   18   32   33                                       
CONECT    5    6    6   27   34                                       
CONECT    6   23    5    5   35                                       
CONECT    7    8                                                      
CONECT    8    1    1    9    7                                       
CONECT    9    2    2    8   13                                       
CONECT   10   11   12   12    2                                       
CONECT   11   10                                                      
CONECT   12   10   10    1   36                                       
CONECT   13   14    9   16   37                                       
CONECT   14   15    4   13   38                                       
CONECT   15   14   39   40                                            
CONECT   16   13   17                                                 
CONECT   17   18   16   41   42                                       
CONECT   18    4   19   17   43                                       
CONECT   19    3   18   20                                            
CONECT   20   19   25   44   46                                       
CONECT   21    3   22   22   25                                       
CONECT   22   21   21   23                                            
CONECT   23   22    6   24                                            
CONECT   24   23   25   25   26                                       
CONECT   25   21   20   24   24                                       
CONECT   26   24   27   27                                            
CONECT   27    5   26   26   45                                       
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   17                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   20                                                      
CONECT   45   27                                                      
CONECT   46   20                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
