COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.490   0.152  -0.022  1.00  0.00           C  
HETATM    2  N   UNL     1      -2.316   0.438   0.576  1.00  0.00           N  
HETATM    3  S   UNL     1      -4.981   0.953   0.235  1.00  0.00           S  
HETATM    4  C   UNL     1      -1.364  -0.427   0.095  1.00  0.00           C  
HETATM    5  N   UNL     1      -1.916  -1.220  -0.765  1.00  0.00           N  
HETATM    6  N   UNL     1      -3.272  -0.880  -0.865  1.00  0.00           N  
HETATM    7  C   UNL     1       0.087  -0.449   0.502  1.00  0.00           C  
HETATM    8  C   UNL     1       0.737  -1.757   0.033  1.00  0.00           C  
HETATM    9  O   UNL     1       2.114  -1.740   0.424  1.00  0.00           O  
HETATM   10  C   UNL     1       2.806  -0.594   0.177  1.00  0.00           C  
HETATM   11  C   UNL     1       2.138   0.596  -0.091  1.00  0.00           C  
HETATM   12  O   UNL     1       0.778   0.642  -0.115  1.00  0.00           O  
HETATM   13  C   UNL     1       2.863   1.753  -0.336  1.00  0.00           C  
HETATM   14  C   UNL     1       4.245   1.722  -0.318  1.00  0.00           C  
HETATM   15  C   UNL     1       4.908   0.538  -0.054  1.00  0.00           C  
HETATM   16  C   UNL     1       4.192  -0.618   0.193  1.00  0.00           C  
HETATM   17  H   UNL     1      -2.169   1.136   1.232  1.00  0.00           H  
HETATM   18  H   UNL     1      -3.932  -1.306  -1.434  1.00  0.00           H  
HETATM   19  H   UNL     1       0.165  -0.367   1.587  1.00  0.00           H  
HETATM   20  H   UNL     1       0.234  -2.605   0.498  1.00  0.00           H  
HETATM   21  H   UNL     1       0.663  -1.836  -1.051  1.00  0.00           H  
HETATM   22  H   UNL     1       2.347   2.679  -0.543  1.00  0.00           H  
HETATM   23  H   UNL     1       4.807   2.623  -0.510  1.00  0.00           H  
HETATM   24  H   UNL     1       5.988   0.516  -0.041  1.00  0.00           H  
HETATM   25  H   UNL     1       4.713  -1.542   0.399  1.00  0.00           H  
CONECT    1    2    3    3    6                                       
CONECT    2    1    4   17                                            
CONECT    3    1    1                                                 
CONECT    4    2    7    5    5                                       
CONECT    5    4    4    6                                            
CONECT    6    1    5   18                                            
CONECT    7    8   12    4   19                                       
CONECT    8    9    7   20   21                                       
CONECT    9   10    8                                                 
CONECT   10    9   16   16   11                                       
CONECT   11   10   12   13   13                                       
CONECT   12   11    7                                                 
CONECT   13   11   11   14   22                                       
CONECT   14   15   15   13   23                                       
CONECT   15   16   14   14   24                                       
CONECT   16   10   10   15   25                                       
CONECT   17    2                                                      
CONECT   18    6                                                      
CONECT   19    7                                                      
CONECT   20    8                                                      
CONECT   21    8                                                      
CONECT   22   13                                                      
CONECT   23   14                                                      
CONECT   24   15                                                      
CONECT   25   16                                                      
MASTER        0    0    0    0    0    0    0    0   25    0   25    0
END
