COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1       1.221  -0.212  -5.193  1.00  0.00           S  
HETATM    2  O   UNL     1       1.736  -1.533  -5.098  1.00  0.00           O  
HETATM    3  O   UNL     1       0.458   0.296  -6.278  1.00  0.00           O  
HETATM    4  N   UNL     1       2.531   0.791  -5.053  1.00  0.00           N  
HETATM    5  C   UNL     1      -1.339   0.378  -1.502  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.553   1.162  -2.637  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.770   0.977  -3.757  1.00  0.00           C  
HETATM    8  C   UNL     1       0.226   0.017  -3.758  1.00  0.00           C  
HETATM    9  C   UNL     1       0.443  -0.762  -2.636  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.329  -0.583  -1.507  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.175   0.572  -0.298  1.00  0.00           C  
HETATM   12  O   UNL     1      -3.051   1.414  -0.295  1.00  0.00           O  
HETATM   13  N   UNL     1      -1.965  -0.186   0.795  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.794   0.004   1.989  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.352  -0.974   3.078  1.00  0.00           C  
HETATM   16  O   UNL     1      -0.982  -0.736   3.406  1.00  0.00           O  
HETATM   17  C   UNL     1      -0.631  -1.676   4.423  1.00  0.00           C  
HETATM   18  C   UNL     1       0.831  -1.474   4.822  1.00  0.00           C  
HETATM   19  O   UNL     1       1.010  -0.146   5.319  1.00  0.00           O  
HETATM   20  C   UNL     1       2.389  -0.020   5.673  1.00  0.00           C  
HETATM   21  C   UNL     1       2.650   1.386   6.215  1.00  0.00           C  
HETATM   22  N   UNL     1       1.816   1.615   7.403  1.00  0.00           N  
HETATM   23  H   UNL     1       3.204   0.810  -5.752  1.00  0.00           H  
HETATM   24  H   UNL     1       2.625   1.359  -4.273  1.00  0.00           H  
HETATM   25  H   UNL     1      -2.331   1.911  -2.639  1.00  0.00           H  
HETATM   26  H   UNL     1      -0.934   1.583  -4.636  1.00  0.00           H  
HETATM   27  H   UNL     1       1.223  -1.510  -2.642  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.157  -1.193  -0.632  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.266  -0.858   0.793  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.839  -0.176   1.738  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.679   1.026   2.350  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.467  -1.996   2.716  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.968  -0.832   3.966  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.768  -2.689   4.044  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.269  -1.525   5.294  1.00  0.00           H  
HETATM   36  H   UNL     1       1.469  -1.625   3.951  1.00  0.00           H  
HETATM   37  H   UNL     1       1.099  -2.191   5.598  1.00  0.00           H  
HETATM   38  H   UNL     1       3.007  -0.190   4.791  1.00  0.00           H  
HETATM   39  H   UNL     1       2.637  -0.756   6.437  1.00  0.00           H  
HETATM   40  H   UNL     1       2.402   2.122   5.450  1.00  0.00           H  
HETATM   41  H   UNL     1       3.701   1.482   6.485  1.00  0.00           H  
HETATM   42  H   UNL     1       2.020   2.549   7.724  1.00  0.00           H  
HETATM   43  H   UNL     1       0.858   1.619   7.088  1.00  0.00           H  
CONECT    1    2    2    3    3                                       
CONECT    1    4    8                                                 
CONECT    2    1    1                                                 
CONECT    3    1    1                                                 
CONECT    4    1   23   24                                            
CONECT    5    6    6   10   11                                       
CONECT    6    5    5    7   25                                       
CONECT    7    6    8    8   26                                       
CONECT    8    1    7    7    9                                       
CONECT    9    8   10   10   27                                       
CONECT   10    5    9    9   28                                       
CONECT   11    5   12   12   13                                       
CONECT   12   11   11                                                 
CONECT   13   11   14   29                                            
CONECT   14   13   15   30   31                                       
CONECT   15   14   16   32   33                                       
CONECT   16   15   17                                                 
CONECT   17   16   18   34   35                                       
CONECT   18   17   19   36   37                                       
CONECT   19   18   20                                                 
CONECT   20   19   21   38   39                                       
CONECT   21   20   22   40   41                                       
CONECT   22   21   42   43                                            
CONECT   23    4                                                      
CONECT   24    4                                                      
CONECT   25    6                                                      
CONECT   26    7                                                      
CONECT   27    9                                                      
CONECT   28   10                                                      
CONECT   29   13                                                      
CONECT   30   14                                                      
CONECT   31   14                                                      
CONECT   32   15                                                      
CONECT   33   15                                                      
CONECT   34   17                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   18                                                      
CONECT   38   20                                                      
CONECT   39   20                                                      
CONECT   40   21                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   22                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
