COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.418   2.058  -0.002  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.128   1.571   0.000  1.00  0.00           C  
HETATM    3  C   UNL     1       0.608   3.832  -0.001  1.00  0.00           C  
HETATM    4  C   UNL     1       0.115   0.184   0.001  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.983  -0.665   0.000  1.00  0.00           C  
HETATM    6  C   UNL     1       1.355  -1.811   0.001  1.00  0.00           C  
HETATM    7  C   UNL     1       2.694  -0.065   0.001  1.00  0.00           C  
HETATM    8  N   UNL     1       2.588  -2.254   0.002  1.00  0.00           N  
HETATM    9  N   UNL     1       3.437  -1.140   0.001  1.00  0.00           N  
HETATM   10  C   UNL     1      -2.501   1.195  -0.002  1.00  0.00           C  
HETATM   11  N   UNL     1       3.160   1.246   0.001  1.00  0.00           N  
HETATM   12  C   UNL     1      -4.645  -0.453  -0.003  1.00  0.00           C  
HETATM   13  O   UNL     1      -3.338  -1.031  -0.001  1.00  0.00           O  
HETATM   14  C   UNL     1      -2.283  -0.172  -0.001  1.00  0.00           C  
HETATM   15  O   UNL     1       0.920   2.438   0.000  1.00  0.00           O  
HETATM   16  S   UNL     1      -0.341  -2.313   0.001  1.00  0.00           S  
HETATM   17  N   UNL     1       1.365  -0.451   0.001  1.00  0.00           N  
HETATM   18  H   UNL     1      -1.585   3.125   0.002  1.00  0.00           H  
HETATM   19  H   UNL     1       0.026   4.075   0.888  1.00  0.00           H  
HETATM   20  H   UNL     1       1.531   4.412  -0.001  1.00  0.00           H  
HETATM   21  H   UNL     1       0.027   4.074  -0.892  1.00  0.00           H  
HETATM   22  H   UNL     1      -3.508   1.585   0.001  1.00  0.00           H  
HETATM   23  H   UNL     1       2.661   1.938   0.462  1.00  0.00           H  
HETATM   24  H   UNL     1       3.984   1.467  -0.460  1.00  0.00           H  
HETATM   25  H   UNL     1      -4.770   0.164   0.887  1.00  0.00           H  
HETATM   26  H   UNL     1      -4.769   0.163  -0.893  1.00  0.00           H  
HETATM   27  H   UNL     1      -5.393  -1.246  -0.003  1.00  0.00           H  
CONECT    1    2    2   10   18                                       
CONECT    2   15    1    1    4                                       
CONECT    3   15   19   20   21                                       
CONECT    4    2   17    5    5                                       
CONECT    5    4    4   14   16                                       
CONECT    6   17    8    8   16                                       
CONECT    7   11   17    9    9                                       
CONECT    8    9    6    6                                            
CONECT    9    7    7    8                                            
CONECT   10    1   14   14   22                                       
CONECT   11    7   23   24                                            
CONECT   12   13   25   26   27                                       
CONECT   13   14   12                                                 
CONECT   14   10   10    5   13                                       
CONECT   15    3    2                                                 
CONECT   16    5    6                                                 
CONECT   17    7    4    6                                            
CONECT   18    1                                                      
CONECT   19    3                                                      
CONECT   20    3                                                      
CONECT   21    3                                                      
CONECT   22   10                                                      
CONECT   23   11                                                      
CONECT   24   11                                                      
CONECT   25   12                                                      
CONECT   26   12                                                      
CONECT   27   12                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
