COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1      -0.891  -0.177  -3.751  1.00  0.00           S  
HETATM    2  N   UNL     1      -2.528   0.069  -3.757  1.00  0.00           N  
HETATM    3  O   UNL     1      -0.401   0.454  -4.926  1.00  0.00           O  
HETATM    4  O   UNL     1      -0.707  -1.546  -3.416  1.00  0.00           O  
HETATM    5  O   UNL     1      -0.315   0.614  -2.586  1.00  0.00           O  
HETATM    6  C   UNL     1      -0.325  -0.253  -1.451  1.00  0.00           C  
HETATM    7  C   UNL     1       0.243   0.485  -0.238  1.00  0.00           C  
HETATM    8  C   UNL     1       0.525  -0.519   0.889  1.00  0.00           C  
HETATM    9  C   UNL     1       0.894   0.178   2.203  1.00  0.00           C  
HETATM   10  C   UNL     1       0.015   1.419   2.436  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.075   2.279   1.186  1.00  0.00           C  
HETATM   12  O   UNL     1      -0.634   1.520   0.120  1.00  0.00           O  
HETATM   13  O   UNL     1      -1.286   0.873   2.808  1.00  0.00           O  
HETATM   14  S   UNL     1      -1.011  -0.521   3.385  1.00  0.00           S  
HETATM   15  O   UNL     1      -1.589  -1.443   2.471  1.00  0.00           O  
HETATM   16  O   UNL     1      -1.299  -0.435   4.774  1.00  0.00           O  
HETATM   17  O   UNL     1       0.509  -0.719   3.281  1.00  0.00           O  
HETATM   18  O   UNL     1       1.743  -1.155   0.415  1.00  0.00           O  
HETATM   19  C   UNL     1       2.385  -0.220  -0.464  1.00  0.00           C  
HETATM   20  C   UNL     1       3.753   0.163   0.104  1.00  0.00           C  
HETATM   21  C   UNL     1       2.562  -0.852  -1.846  1.00  0.00           C  
HETATM   22  O   UNL     1       1.557   0.955  -0.570  1.00  0.00           O  
HETATM   23  H   UNL     1      -3.080  -0.356  -4.431  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.935   0.638  -3.085  1.00  0.00           H  
HETATM   25  H   UNL     1       0.284  -1.132  -1.661  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.348  -0.564  -1.240  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.289  -1.231   1.019  1.00  0.00           H  
HETATM   28  H   UNL     1       1.955   0.424   2.242  1.00  0.00           H  
HETATM   29  H   UNL     1       0.416   2.008   3.260  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.708   3.144   1.387  1.00  0.00           H  
HETATM   31  H   UNL     1       0.921   2.618   0.906  1.00  0.00           H  
HETATM   32  H   UNL     1       4.378  -0.726   0.178  1.00  0.00           H  
HETATM   33  H   UNL     1       4.230   0.888  -0.555  1.00  0.00           H  
HETATM   34  H   UNL     1       3.625   0.601   1.093  1.00  0.00           H  
HETATM   35  H   UNL     1       2.757  -0.070  -2.580  1.00  0.00           H  
HETATM   36  H   UNL     1       3.401  -1.547  -1.823  1.00  0.00           H  
HETATM   37  H   UNL     1       1.653  -1.388  -2.119  1.00  0.00           H  
CONECT    1    2    3    3    4                                       
CONECT    1    4    5                                                 
CONECT    2    1   23   24                                            
CONECT    3    1    1                                                 
CONECT    4    1    1                                                 
CONECT    5    1    6                                                 
CONECT    6    5    7   25   26                                       
CONECT    7    6    8   12   22                                       
CONECT    8    7    9   18   27                                       
CONECT    9    8   10   17   28                                       
CONECT   10    9   11   13   29                                       
CONECT   11   10   12   30   31                                       
CONECT   12    7   11                                                 
CONECT   13   10   14                                                 
CONECT   14   13   15   15   16                                       
CONECT   14   16   17                                                 
CONECT   15   14   14                                                 
CONECT   16   14   14                                                 
CONECT   17    9   14                                                 
CONECT   18    8   19                                                 
CONECT   19   18   20   21   22                                       
CONECT   20   19   32   33   34                                       
CONECT   21   19   35   36   37                                       
CONECT   22    7   19                                                 
CONECT   23    2                                                      
CONECT   24    2                                                      
CONECT   25    6                                                      
CONECT   26    6                                                      
CONECT   27    8                                                      
CONECT   28    9                                                      
CONECT   29   10                                                      
CONECT   30   11                                                      
CONECT   31   11                                                      
CONECT   32   20                                                      
CONECT   33   20                                                      
CONECT   34   20                                                      
CONECT   35   21                                                      
CONECT   36   21                                                      
CONECT   37   21                                                      
MASTER        0    0    0    0    0    0    0    0   37    0   37    0
END
