COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK     1       1.729   0.238   2.609  1.00  0.00           N  
HETATM    2  C   UNK     1       0.277   0.461   2.630  1.00  0.00           C  
HETATM    3  C   UNK     1      -0.364  -0.246   1.436  1.00  0.00           C  
HETATM    4  S   UNK     1       0.326   0.417  -0.103  1.00  0.00           S  
HETATM    5  C   UNK     1      -0.589  -0.575  -1.314  1.00  0.00           C  
HETATM    6  C   UNK     1      -0.297  -0.090   3.910  1.00  0.00           C  
HETATM    7  O   UNK     1       0.226  -1.037   4.448  1.00  0.00           O  
HETATM    8  O   UNK     1      -1.389   0.470   4.451  1.00  0.00           O  
HETATM    9  P   UNK     1      -0.078  -0.102  -2.999  1.00  0.00           P  
HETATM   10  O   UNK     1       1.373  -0.343  -3.160  1.00  0.00           O  
HETATM   11  O   UNK     1      -0.891  -0.984  -4.073  1.00  0.00           O  
HETATM   12  O   UNK     1      -0.392   1.458  -3.237  1.00  0.00           O  
HETATM   13  H   UNK     1       2.053   0.527   1.698  1.00  0.00           H  
HETATM   14  H   UNK     1       1.870  -0.758   2.665  1.00  0.00           H  
HETATM   15  H   UNK     1       0.072   1.530   2.572  1.00  0.00           H  
HETATM   16  H   UNK     1      -0.160  -1.315   1.494  1.00  0.00           H  
HETATM   17  H   UNK     1      -1.442  -0.081   1.452  1.00  0.00           H  
HETATM   18  H   UNK     1      -0.376  -1.632  -1.153  1.00  0.00           H  
HETATM   19  H   UNK     1      -1.658  -0.397  -1.195  1.00  0.00           H  
HETATM   20  H   UNK     1      -1.758   0.115   5.272  1.00  0.00           H  
HETATM   21  H   UNK     1      -0.591  -0.703  -4.949  1.00  0.00           H  
HETATM   22  H   UNK     1      -1.346   1.571  -3.123  1.00  0.00           H  
CONECT    1    2   13   14                                            
CONECT    2    1    3    6   15                                       
CONECT    3    2    4   16   17                                       
CONECT    4    3    5                                                 
CONECT    5    4    9   18   19                                       
CONECT    6    2    7    7    8                                       
CONECT    7    6    6                                                 
CONECT    8    6   20                                                 
CONECT    9    5   10   10   11                                       
CONECT    9   12                                                      
CONECT   10    9    9                                                 
CONECT   11    9   21                                                 
CONECT   12    9   22                                                 
CONECT   13    1                                                      
CONECT   14    1                                                      
CONECT   15    2                                                      
CONECT   16    3                                                      
CONECT   17    3                                                      
CONECT   18    5                                                      
CONECT   19    5                                                      
CONECT   20    8                                                      
CONECT   21   11                                                      
CONECT   22   12                                                      
MASTER        0    0    0    0    0    0    0    0   22    0   22    0
END
