COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.842  -0.260  -2.133  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.974   0.075  -0.646  1.00  0.00           C  
HETATM    3  O   UNL     1      -1.359   1.338  -0.386  1.00  0.00           O  
HETATM    4  C   UNL     1      -0.042   1.325  -0.054  1.00  0.00           C  
HETATM    5  C   UNL     1       0.693   0.167   0.036  1.00  0.00           C  
HETATM    6  C   UNL     1       1.986   0.335   0.376  1.00  0.00           C  
HETATM    7  N   UNL     1       2.912  -0.693   0.525  1.00  0.00           N  
HETATM    8  C   UNL     1       2.748  -1.831   1.259  1.00  0.00           C  
HETATM    9  N   UNL     1       3.813  -2.573   1.176  1.00  0.00           N  
HETATM   10  C   UNL     1       4.735  -1.965   0.384  1.00  0.00           C  
HETATM   11  C   UNL     1       6.022  -2.312  -0.033  1.00  0.00           C  
HETATM   12  C   UNL     1       6.724  -1.463  -0.859  1.00  0.00           C  
HETATM   13  C   UNL     1       6.164  -0.266  -1.280  1.00  0.00           C  
HETATM   14  C   UNL     1       4.894   0.091  -0.877  1.00  0.00           C  
HETATM   15  C   UNL     1       4.170  -0.754  -0.049  1.00  0.00           C  
HETATM   16  S   UNL     1       2.331   2.044   0.605  1.00  0.00           S  
HETATM   17  C   UNL     1       0.669   2.468   0.215  1.00  0.00           C  
HETATM   18  C   UNL     1       0.147   3.781   0.186  1.00  0.00           C  
HETATM   19  N   UNL     1       0.945   4.830   0.469  1.00  0.00           N  
HETATM   20  O   UNL     1      -1.024   3.965  -0.096  1.00  0.00           O  
HETATM   21  C   UNL     1      -3.433   0.141  -0.274  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.091   1.358  -0.269  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.429   1.419   0.072  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.110   0.263   0.407  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.453  -0.953   0.401  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.116  -1.014   0.056  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.401  -2.341   0.044  1.00  0.00           C  
HETATM   28  F   UNL     1      -4.293  -3.355   0.410  1.00  0.00           F  
HETATM   29  F   UNL     1      -2.909  -2.594  -1.241  1.00  0.00           F  
HETATM   30  F   UNL     1      -2.337  -2.305   0.952  1.00  0.00           F  
HETATM   31  H   UNL     1      -0.786  -0.308  -2.402  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.312  -1.224  -2.331  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.333   0.512  -2.725  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.484  -0.697  -0.054  1.00  0.00           H  
HETATM   35  H   UNL     1       0.266  -0.807  -0.153  1.00  0.00           H  
HETATM   36  H   UNL     1       1.863  -2.079   1.826  1.00  0.00           H  
HETATM   37  H   UNL     1       6.465  -3.242   0.291  1.00  0.00           H  
HETATM   38  H   UNL     1       7.720  -1.731  -1.181  1.00  0.00           H  
HETATM   39  H   UNL     1       6.726   0.391  -1.927  1.00  0.00           H  
HETATM   40  H   UNL     1       4.464   1.025  -1.208  1.00  0.00           H  
HETATM   41  H   UNL     1       1.877   4.684   0.693  1.00  0.00           H  
HETATM   42  H   UNL     1       0.586   5.731   0.449  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.559   2.260  -0.531  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.942   2.369   0.077  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.155   0.311   0.674  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.985  -1.855   0.663  1.00  0.00           H  
CONECT    1    2   31   32   33                                       
CONECT    2    1    3   21   34                                       
CONECT    3    2    4                                                 
CONECT    4    3    5   17   17                                       
CONECT    5    4    6    6   35                                       
CONECT    6    5    5    7   16                                       
CONECT    7    6    8   15                                            
CONECT    8    7    9    9   36                                       
CONECT    9    8    8   10                                            
CONECT   10    9   11   11   15                                       
CONECT   11   10   10   12   37                                       
CONECT   12   11   13   13   38                                       
CONECT   13   12   12   14   39                                       
CONECT   14   13   15   15   40                                       
CONECT   15    7   10   14   14                                       
CONECT   16    6   17                                                 
CONECT   17    4    4   16   18                                       
CONECT   18   17   19   20   20                                       
CONECT   19   18   41   42                                            
CONECT   20   18   18                                                 
CONECT   21    2   22   26   26                                       
CONECT   22   21   23   23   43                                       
CONECT   23   22   22   24   44                                       
CONECT   24   23   25   25   45                                       
CONECT   25   24   24   26   46                                       
CONECT   26   21   21   25   27                                       
CONECT   27   26   28   29   30                                       
CONECT   28   27                                                      
CONECT   29   27                                                      
CONECT   30   27                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    5                                                      
CONECT   36    8                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   19                                                      
CONECT   42   19                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
