COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.824   1.570   1.959  1.00  0.00           C  
HETATM    2  C   UNL     1       4.384   0.998  -1.485  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.015  -0.386   0.652  1.00  0.00           C  
HETATM    4  C   UNL     1       3.257  -1.410   0.556  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.426  -0.215   0.237  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.017   0.131  -0.530  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.104   1.177  -0.516  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.288  -1.310   0.254  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.605  -1.136  -0.135  1.00  0.00           C  
HETATM   10  F   UNL     1      -7.294   0.344  -0.917  1.00  0.00           F  
HETATM   11  N   UNL     1      -3.859   0.981  -0.141  1.00  0.00           N  
HETATM   12  O   UNL     1      -1.613  -1.478   1.004  1.00  0.00           O  
HETATM   13  N   UNL     1      -1.176   0.668   0.638  1.00  0.00           N  
HETATM   14  C   UNL     1       0.221   0.499   1.048  1.00  0.00           C  
HETATM   15  C   UNL     1       1.246   1.489   0.490  1.00  0.00           C  
HETATM   16  C   UNL     1       2.648   0.957   0.186  1.00  0.00           C  
HETATM   17  N   UNL     1       2.934  -0.237   0.944  1.00  0.00           N  
HETATM   18  C   UNL     1       3.736   2.014   0.533  1.00  0.00           C  
HETATM   19  O   UNL     1       4.848   1.699  -0.321  1.00  0.00           O  
HETATM   20  C   UNL     1       2.866   0.817  -1.328  1.00  0.00           C  
HETATM   21  C   UNL     1       2.403  -0.524  -1.864  1.00  0.00           C  
HETATM   22  S   UNL     1       3.414  -1.843  -1.143  1.00  0.00           S  
HETATM   23  N   UNL     1       3.492  -2.376   1.506  1.00  0.00           N  
HETATM   24  H   UNL     1       0.183   2.400   2.253  1.00  0.00           H  
HETATM   25  H   UNL     1       1.546   1.245   2.708  1.00  0.00           H  
HETATM   26  H   UNL     1       4.598   1.584  -2.380  1.00  0.00           H  
HETATM   27  H   UNL     1       4.872   0.026  -1.553  1.00  0.00           H  
HETATM   28  H   UNL     1      -5.419   2.164  -0.822  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.933  -2.281   0.566  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.297  -1.965  -0.132  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.496   1.540   0.356  1.00  0.00           H  
HETATM   32  H   UNL     1       0.545  -0.531   1.198  1.00  0.00           H  
HETATM   33  H   UNL     1       0.881   2.266  -0.182  1.00  0.00           H  
HETATM   34  H   UNL     1       3.369   3.019   0.322  1.00  0.00           H  
HETATM   35  H   UNL     1       4.026   1.929   1.580  1.00  0.00           H  
HETATM   36  H   UNL     1       2.344   1.619  -1.850  1.00  0.00           H  
HETATM   37  H   UNL     1       1.358  -0.681  -1.598  1.00  0.00           H  
HETATM   38  H   UNL     1       2.507  -0.538  -2.949  1.00  0.00           H  
HETATM   39  H   UNL     1       3.411  -2.160   2.448  1.00  0.00           H  
HETATM   40  H   UNL     1       3.738  -3.274   1.235  1.00  0.00           H  
CONECT    1   14   15   24   25                                       
CONECT    2   20   19   26   27                                       
CONECT    3    5   13   12   12                                       
CONECT    4   23   17   17   22                                       
CONECT    5   11   11    8    3                                       
CONECT    6   10    7    7    9                                       
CONECT    7    6    6   11   28                                       
CONECT    8    9    9    5   29                                       
CONECT    9    6    8    8   30                                       
CONECT   10    6                                                      
CONECT   11    7    5    5                                            
CONECT   12    3    3                                                 
CONECT   13    3   14   31                                            
CONECT   14   13    1   15   32                                       
CONECT   15   14    1   16   33                                       
CONECT   16   15   17   20   18                                       
CONECT   17    4    4   16                                            
CONECT   18   16   19   34   35                                       
CONECT   19   18    2                                                 
CONECT   20   16   21    2   36                                       
CONECT   21   22   20   37   38                                       
CONECT   22    4   21                                                 
CONECT   23    4   39   40                                            
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    2                                                      
CONECT   28    7                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31   13                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   18                                                      
CONECT   35   18                                                      
CONECT   36   20                                                      
CONECT   37   21                                                      
CONECT   38   21                                                      
CONECT   39   23                                                      
CONECT   40   23                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
