COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK     1       2.179   1.425   1.137  1.00  0.00           N  
HETATM    2  C   UNK     1       1.883   0.238   0.323  1.00  0.00           C  
HETATM    3  C   UNK     1       1.190   0.668  -0.971  1.00  0.00           C  
HETATM    4  C   UNK     1       3.167  -0.478  -0.008  1.00  0.00           C  
HETATM    5  O   UNK     1       4.221   0.108   0.063  1.00  0.00           O  
HETATM    6  O   UNK     1       3.139  -1.767  -0.381  1.00  0.00           O  
HETATM    7  S   UNK     1      -0.385   1.477  -0.575  1.00  0.00           S  
HETATM    8 AS   UNK     1      -1.694  -0.236   0.030  1.00  0.00          As  
HETATM    9  C   UNK     1      -0.995  -1.044   1.709  1.00  0.00           C  
HETATM   10  C   UNK     1      -3.548   0.420   0.331  1.00  0.00           C  
HETATM   11  O   UNK     1      -1.700  -1.327  -1.118  1.00  0.00           O  
HETATM   12  H   UNK     1       2.682   2.115   0.600  1.00  0.00           H  
HETATM   13  H   UNK     1       1.335   1.816   1.528  1.00  0.00           H  
HETATM   14  H   UNK     1       1.227  -0.430   0.882  1.00  0.00           H  
HETATM   15  H   UNK     1       1.830   1.364  -1.512  1.00  0.00           H  
HETATM   16  H   UNK     1       1.002  -0.209  -1.591  1.00  0.00           H  
HETATM   17  H   UNK     1       3.988  -2.183  -0.583  1.00  0.00           H  
HETATM   18  H   UNK     1      -0.867  -0.266   2.461  1.00  0.00           H  
HETATM   19  H   UNK     1      -1.701  -1.790   2.075  1.00  0.00           H  
HETATM   20  H   UNK     1      -0.035  -1.520   1.511  1.00  0.00           H  
HETATM   21  H   UNK     1      -3.931   0.862  -0.589  1.00  0.00           H  
HETATM   22  H   UNK     1      -4.185  -0.414   0.626  1.00  0.00           H  
HETATM   23  H   UNK     1      -3.544   1.171   1.121  1.00  0.00           H  
CONECT    1    2   12   13                                            
CONECT    2    1    3    4   14                                       
CONECT    3    2    7   15   16                                       
CONECT    4    2    5    5    6                                       
CONECT    5    4    4                                                 
CONECT    6    4   17                                                 
CONECT    7    3    8                                                 
CONECT    8    7    9   10   11                                       
CONECT    8   11                                                      
CONECT    9    8   18   19   20                                       
CONECT   10    8   21   22   23                                       
CONECT   11    8    8                                                 
CONECT   12    1                                                      
CONECT   13    1                                                      
CONECT   14    2                                                      
CONECT   15    3                                                      
CONECT   16    3                                                      
CONECT   17    6                                                      
CONECT   18    9                                                      
CONECT   19    9                                                      
CONECT   20    9                                                      
CONECT   21   10                                                      
CONECT   22   10                                                      
CONECT   23   10                                                      
MASTER        0    0    0    0    0    0    0    0   23    0   23    0
END
