COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       5.442   0.930   0.495  1.00  0.00           N  
HETATM    2  C   UNL     1       4.626  -0.291   0.448  1.00  0.00           C  
HETATM    3  C   UNL     1       3.181   0.077   0.230  1.00  0.00           C  
HETATM    4  O   UNL     1       2.894   1.162  -0.230  1.00  0.00           O  
HETATM    5  C   UNL     1       5.106  -1.178  -0.704  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.567   3.209  -1.082  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.847  -0.530   0.082  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.699  -1.390  -0.565  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.851   0.601   0.796  1.00  0.00           C  
HETATM   10  C   UNL     1       7.341  -0.281  -0.462  1.00  0.00           C  
HETATM   11  C   UNL     1       6.861   0.605   0.689  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.435   2.015  -0.777  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.081  -1.476  -0.584  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.232   0.506   0.771  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.076  -0.349   0.127  1.00  0.00           C  
HETATM   16  C   UNL     1       0.877  -0.461   0.347  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.854   0.829  -0.262  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.604  -0.254   0.152  1.00  0.00           C  
HETATM   19  N   UNL     1       0.465   0.665  -0.136  1.00  0.00           N  
HETATM   20  N   UNL     1       6.526  -1.503  -0.509  1.00  0.00           N  
HETATM   21  N   UNL     1       2.207  -0.800   0.547  1.00  0.00           N  
HETATM   22  O   UNL     1      -2.632   2.069  -0.972  1.00  0.00           O  
HETATM   23  O   UNL     1      -5.688  -2.489  -1.257  1.00  0.00           O  
HETATM   24  O   UNL     1      -5.987   1.431   1.421  1.00  0.00           O  
HETATM   25  S   UNL     1      -0.494  -1.499   0.719  1.00  0.00           S  
HETATM   26  H   UNL     1       5.309   1.486  -0.337  1.00  0.00           H  
HETATM   27  H   UNL     1       4.726  -0.832   1.389  1.00  0.00           H  
HETATM   28  H   UNL     1       4.522  -2.098  -0.722  1.00  0.00           H  
HETATM   29  H   UNL     1       4.981  -0.648  -1.648  1.00  0.00           H  
HETATM   30  H   UNL     1       0.178   2.935  -1.829  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.186   4.019  -1.466  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.065   3.535  -0.171  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.924  -0.598   0.060  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.104  -2.128  -1.083  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.374   1.408   1.332  1.00  0.00           H  
HETATM   36  H   UNL     1       7.241   0.259  -1.404  1.00  0.00           H  
HETATM   37  H   UNL     1       8.387  -0.548  -0.305  1.00  0.00           H  
HETATM   38  H   UNL     1       7.446   1.525   0.708  1.00  0.00           H  
HETATM   39  H   UNL     1       6.987   0.075   1.633  1.00  0.00           H  
HETATM   40  H   UNL     1       6.659  -2.059   0.322  1.00  0.00           H  
HETATM   41  H   UNL     1       2.437  -1.667   0.915  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.885  -2.285  -2.181  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.186   1.201   2.339  1.00  0.00           H  
CONECT    1    2   11   26                                            
CONECT    2    3    1    5   27                                       
CONECT    3    4    4   21    2                                       
CONECT    4    3    3                                                 
CONECT    5    2   20   28   29                                       
CONECT    6   12   30   31   32                                       
CONECT    7   13   13   14   33                                       
CONECT    8   13   15   15   34                                       
CONECT    9   14   14   15   35                                       
CONECT   10   11   20   36   37                                       
CONECT   11    1   10   38   39                                       
CONECT   12    6   17   22   22                                       
CONECT   13   23    7    7    8                                       
CONECT   14    7   24    9    9                                       
CONECT   15    8    8    9   18                                       
CONECT   16   25   19   19   21                                       
CONECT   17   18   18   12   19                                       
CONECT   18   15   17   17   25                                       
CONECT   19   17   16   16                                            
CONECT   20    5   10   40                                            
CONECT   21   16    3   41                                            
CONECT   22   12   12                                                 
CONECT   23   13   42                                                 
CONECT   24   14   43                                                 
CONECT   25   18   16                                                 
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   20                                                      
CONECT   41   21                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
