COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.157   0.363  -0.177  1.00  0.00           C  
HETATM    2  O   UNL     1       6.365  -0.189  -0.370  1.00  0.00           O  
HETATM    3  O   UNL     1       5.030   1.564  -0.208  1.00  0.00           O  
HETATM    4  C   UNL     1       3.959  -0.515   0.078  1.00  0.00           C  
HETATM    5  C   UNL     1       2.716   0.358   0.263  1.00  0.00           C  
HETATM    6  C   UNL     1       1.500  -0.533   0.522  1.00  0.00           C  
HETATM    7  C   UNL     1       0.258   0.340   0.707  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.959  -0.551   0.965  1.00  0.00           C  
HETATM    9  S   UNL     1      -1.424  -1.494  -0.551  1.00  0.00           S  
HETATM   10  C   UNL     1      -3.225  -1.595  -0.226  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.483  -0.280   0.541  1.00  0.00           C  
HETATM   12  N   UNL     1      -3.905   0.751  -0.408  1.00  0.00           N  
HETATM   13  C   UNL     1      -3.047   1.778  -0.343  1.00  0.00           C  
HETATM   14  O   UNL     1      -3.154   2.776  -1.028  1.00  0.00           O  
HETATM   15  N   UNL     1      -2.060   1.604   0.547  1.00  0.00           N  
HETATM   16  C   UNL     1      -2.227   0.297   1.200  1.00  0.00           C  
HETATM   17  O   UNL     1      -0.859  -2.796  -0.499  1.00  0.00           O  
HETATM   18  H   UNL     1       7.133   0.374  -0.534  1.00  0.00           H  
HETATM   19  H   UNL     1       3.811  -1.183  -0.771  1.00  0.00           H  
HETATM   20  H   UNL     1       4.126  -1.105   0.979  1.00  0.00           H  
HETATM   21  H   UNL     1       2.865   1.026   1.111  1.00  0.00           H  
HETATM   22  H   UNL     1       2.549   0.948  -0.639  1.00  0.00           H  
HETATM   23  H   UNL     1       1.352  -1.201  -0.327  1.00  0.00           H  
HETATM   24  H   UNL     1       1.667  -1.123   1.423  1.00  0.00           H  
HETATM   25  H   UNL     1       0.406   1.008   1.555  1.00  0.00           H  
HETATM   26  H   UNL     1       0.091   0.930  -0.195  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.777  -1.224   1.804  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.450  -2.462   0.397  1.00  0.00           H  
HETATM   29  H   UNL     1      -3.795  -1.625  -1.155  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.256  -0.432   1.295  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.678   0.699  -0.991  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.349   2.239   0.731  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.394   0.431   2.269  1.00  0.00           H  
CONECT    1    2    3    3    4                                       
CONECT    2    1   18                                                 
CONECT    3    1    1                                                 
CONECT    4    1    5   19   20                                       
CONECT    5    4    6   21   22                                       
CONECT    6    5    7   23   24                                       
CONECT    7    6    8   25   26                                       
CONECT    8    7    9   16   27                                       
CONECT    9    8   10   17   17                                       
CONECT   10    9   11   28   29                                       
CONECT   11   10   12   16   30                                       
CONECT   12   11   13   31                                            
CONECT   13   12   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   32                                            
CONECT   16    8   11   15   33                                       
CONECT   17    9    9                                                 
CONECT   18    2                                                      
CONECT   19    4                                                      
CONECT   20    4                                                      
CONECT   21    5                                                      
CONECT   22    5                                                      
CONECT   23    6                                                      
CONECT   24    6                                                      
CONECT   25    7                                                      
CONECT   26    7                                                      
CONECT   27    8                                                      
CONECT   28   10                                                      
CONECT   29   10                                                      
CONECT   30   11                                                      
CONECT   31   12                                                      
CONECT   32   15                                                      
CONECT   33   16                                                      
MASTER        0    0    0    0    0    0    0    0   33    0   33    0
END
