COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.236   1.089  -0.533  1.00  0.00           C  
HETATM    2  C   UNL     1       2.303  -0.050  -0.110  1.00  0.00           C  
HETATM    3  N   UNL     1      -1.759  -0.185  -0.979  1.00  0.00           N  
HETATM    4  C   UNL     1      -0.401  -0.140  -0.688  1.00  0.00           C  
HETATM    5  C   UNL     1       1.575   1.137  -0.241  1.00  0.00           C  
HETATM    6  C   UNL     1       3.744  -0.003   0.198  1.00  0.00           C  
HETATM    7  C   UNL     1       1.662  -1.282  -0.272  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.589  -1.214   1.399  1.00  0.00           C  
HETATM    9  C   UNL     1       0.322  -1.323  -0.559  1.00  0.00           C  
HETATM   10  O   UNL     1       4.375  -1.035   0.312  1.00  0.00           O  
HETATM   11  O   UNL     1       4.360   1.185   0.354  1.00  0.00           O  
HETATM   12  S   UNL     1      -2.871   0.126   0.209  1.00  0.00           S  
HETATM   13  O   UNL     1      -4.109  -0.028  -0.470  1.00  0.00           O  
HETATM   14  O   UNL     1      -2.441   1.380   0.722  1.00  0.00           O  
HETATM   15  H   UNL     1      -0.327   2.005  -0.635  1.00  0.00           H  
HETATM   16  H   UNL     1      -2.057  -0.398  -1.877  1.00  0.00           H  
HETATM   17  H   UNL     1       2.067   2.090  -0.116  1.00  0.00           H  
HETATM   18  H   UNL     1       2.221  -2.201  -0.172  1.00  0.00           H  
HETATM   19  H   UNL     1      -2.657  -2.174   0.887  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.598  -1.106   1.840  1.00  0.00           H  
HETATM   21  H   UNL     1      -3.344  -1.167   2.184  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.175  -2.274  -0.684  1.00  0.00           H  
HETATM   23  H   UNL     1       5.305   1.217   0.557  1.00  0.00           H  
CONECT    1    4    5    5   15                                       
CONECT    2    5    6    7    7                                       
CONECT    3    4   12   16                                            
CONECT    4    1    3    9    9                                       
CONECT    5    1    1    2   17                                       
CONECT    6    2   10   10   11                                       
CONECT    7    2    2    9   18                                       
CONECT    8   12   19   20   21                                       
CONECT    9    4    4    7   22                                       
CONECT   10    6    6                                                 
CONECT   11    6   23                                                 
CONECT   12    3    8   13   13                                       
CONECT   12   14   14                                                 
CONECT   13   12   12                                                 
CONECT   14   12   12                                                 
CONECT   15    1                                                      
CONECT   16    3                                                      
CONECT   17    5                                                      
CONECT   18    7                                                      
CONECT   19    8                                                      
CONECT   20    8                                                      
CONECT   21    8                                                      
CONECT   22    9                                                      
CONECT   23   11                                                      
MASTER        0    0    0    0    0    0    0    0   23    0   23    0
END
