COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.625  -0.648  -0.001  1.00  0.00           C  
HETATM    2  C   UNL     1       3.228  -1.923   0.004  1.00  0.00           C  
HETATM    3  C   UNL     1       4.595  -2.046   0.002  1.00  0.00           C  
HETATM    4  C   UNL     1       5.405  -0.919  -0.002  1.00  0.00           C  
HETATM    5  C   UNL     1       4.838   0.336  -0.007  1.00  0.00           C  
HETATM    6  C   UNL     1       3.453   0.479   0.000  1.00  0.00           C  
HETATM    7  N   UNL     1      -0.307   1.394   0.001  1.00  0.00           N  
HETATM    8  C   UNL     1      -1.344   0.534   0.000  1.00  0.00           C  
HETATM    9  O   UNL     1      -1.141  -0.662  -0.001  1.00  0.00           O  
HETATM   10  C   UNL     1      -2.757   1.057   0.001  1.00  0.00           C  
HETATM   11  S   UNL     1      -3.919  -0.336  -0.001  1.00  0.00           S  
HETATM   12  O   UNL     1      -5.294   0.316   0.000  1.00  0.00           O  
HETATM   13  O   UNL     1      -3.861  -1.032  -1.238  1.00  0.00           O  
HETATM   14  O   UNL     1      -3.861  -1.034   1.236  1.00  0.00           O  
HETATM   15  C   UNL     1       0.992   0.913   0.001  1.00  0.00           C  
HETATM   16  N   UNL     1       1.314  -0.334   0.000  1.00  0.00           N  
HETATM   17  S   UNL     1       2.435   1.917   0.002  1.00  0.00           S  
HETATM   18  H   UNL     1       2.610  -2.809   0.008  1.00  0.00           H  
HETATM   19  H   UNL     1       5.044  -3.028   0.006  1.00  0.00           H  
HETATM   20  H   UNL     1       6.479  -1.027  -0.002  1.00  0.00           H  
HETATM   21  H   UNL     1       5.470   1.211  -0.010  1.00  0.00           H  
HETATM   22  H   UNL     1      -0.470   2.350   0.002  1.00  0.00           H  
HETATM   23  H   UNL     1      -2.920   1.664   0.891  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.919   1.666  -0.888  1.00  0.00           H  
HETATM   25  H   UNL     1      -6.028  -0.314  -0.001  1.00  0.00           H  
CONECT    1    2   16    6    6                                       
CONECT    2    3    3    1   18                                       
CONECT    3    2    2    4   19                                       
CONECT    4    3    5    5   20                                       
CONECT    5    4    4    6   21                                       
CONECT    6    1    1    5   17                                       
CONECT    7   15    8   22                                            
CONECT    8    7   10    9    9                                       
CONECT    9    8    8                                                 
CONECT   10    8   11   23   24                                       
CONECT   11   10   13   13   12                                       
CONECT   11   14   14                                                 
CONECT   12   11   25                                                 
CONECT   13   11   11                                                 
CONECT   14   11   11                                                 
CONECT   15   16   16    7   17                                       
CONECT   16    1   15   15                                            
CONECT   17    6   15                                                 
CONECT   18    2                                                      
CONECT   19    3                                                      
CONECT   20    4                                                      
CONECT   21    5                                                      
CONECT   22    7                                                      
CONECT   23   10                                                      
CONECT   24   10                                                      
CONECT   25   12                                                      
MASTER        0    0    0    0    0    0    0    0   25    0   25    0
END
