COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.724   1.112   1.161  1.00  0.00           N  
HETATM    2  C   UNL     1       3.186   0.264   0.310  1.00  0.00           C  
HETATM    3  N   UNL     1       2.332   0.956  -0.503  1.00  0.00           N  
HETATM    4  C   UNL     1       2.374   2.252  -0.113  1.00  0.00           C  
HETATM    5  C   UNL     1       3.246   2.331   0.923  1.00  0.00           C  
HETATM    6  C   UNL     1       1.524   0.400  -1.591  1.00  0.00           C  
HETATM    7  C   UNL     1       0.202  -0.073  -1.043  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.831   0.821  -0.868  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.054   0.388  -0.363  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.246  -0.956  -0.028  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.173  -1.853  -0.214  1.00  0.00           C  
HETATM   12  C   UNL     1       0.024  -1.410  -0.720  1.00  0.00           C  
HETATM   13  N   UNL     1      -3.481  -1.206   0.451  1.00  0.00           N  
HETATM   14  C   UNL     1      -4.306  -0.219   0.534  1.00  0.00           C  
HETATM   15  S   UNL     1      -3.546   1.263  -0.028  1.00  0.00           S  
HETATM   16  N   UNL     1      -5.601  -0.313   1.001  1.00  0.00           N  
HETATM   17  C   UNL     1       3.456  -1.182   0.246  1.00  0.00           C  
HETATM   18  O   UNL     1       4.228  -1.766   1.184  1.00  0.00           O  
HETATM   19  O   UNL     1       2.984  -1.849  -0.654  1.00  0.00           O  
HETATM   20  H   UNL     1       1.819   3.070  -0.547  1.00  0.00           H  
HETATM   21  H   UNL     1       3.506   3.229   1.463  1.00  0.00           H  
HETATM   22  H   UNL     1       1.351   1.169  -2.344  1.00  0.00           H  
HETATM   23  H   UNL     1       2.051  -0.440  -2.043  1.00  0.00           H  
HETATM   24  H   UNL     1      -0.692   1.861  -1.124  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.296  -2.896   0.037  1.00  0.00           H  
HETATM   26  H   UNL     1       0.837  -2.107  -0.859  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.949  -1.168   1.298  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.164   0.477   1.033  1.00  0.00           H  
HETATM   29  H   UNL     1       4.378  -2.718   1.100  1.00  0.00           H  
CONECT    1    2    2    5                                            
CONECT    2    3   17    1    1                                       
CONECT    3    6    4    2                                            
CONECT    4    3    5    5   20                                       
CONECT    5    4    4    1   21                                       
CONECT    6    7    3   22   23                                       
CONECT    7   12   12    8    6                                       
CONECT    8    9    9    7   24                                       
CONECT    9   10   15    8    8                                       
CONECT   10   13   11   11    9                                       
CONECT   11   10   10   12   25                                       
CONECT   12   11    7    7   26                                       
CONECT   13   14   14   10                                            
CONECT   14   16   13   13   15                                       
CONECT   15   14    9                                                 
CONECT   16   14   27   28                                            
CONECT   17   19   19    2   18                                       
CONECT   18   17   29                                                 
CONECT   19   17   17                                                 
CONECT   20    4                                                      
CONECT   21    5                                                      
CONECT   22    6                                                      
CONECT   23    6                                                      
CONECT   24    8                                                      
CONECT   25   11                                                      
CONECT   26   12                                                      
CONECT   27   16                                                      
CONECT   28   16                                                      
CONECT   29   18                                                      
MASTER        0    0    0    0    0    0    0    0   29    0   29    0
END
