COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.959  -0.899  -0.118  1.00  0.00           N  
HETATM    2  C   UNL     1      -1.942   0.015   0.643  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.483   0.278   0.374  1.00  0.00           C  
HETATM    4  C   UNL     1       1.753  -0.496   0.156  1.00  0.00           C  
HETATM    5  C   UNL     1       2.773  -1.394   0.147  1.00  0.00           C  
HETATM    6  N   UNL     1       0.402  -0.739   0.405  1.00  0.00           N  
HETATM    7  C   UNL     1      -2.635  -2.330  -0.010  1.00  0.00           C  
HETATM    8  O   UNL     1      -2.668   1.250   0.636  1.00  0.00           O  
HETATM    9  C   UNL     1      -2.528  -0.876  -0.474  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.937  -0.257  -0.683  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.643   1.240  -0.418  1.00  0.00           C  
HETATM   12  N   UNL     1       4.067   0.358  -0.342  1.00  0.00           N  
HETATM   13  O   UNL     1      -0.104   1.404   0.130  1.00  0.00           O  
HETATM   14  S   UNL     1       2.505   1.012  -0.208  1.00  0.00           S  
HETATM   15  H   UNL     1      -2.059  -0.478   1.608  1.00  0.00           H  
HETATM   16  H   UNL     1       2.617  -2.444   0.343  1.00  0.00           H  
HETATM   17  H   UNL     1       0.099  -1.640   0.600  1.00  0.00           H  
HETATM   18  H   UNL     1      -3.287  -2.386   0.862  1.00  0.00           H  
HETATM   19  H   UNL     1      -3.051  -2.938  -0.814  1.00  0.00           H  
HETATM   20  H   UNL     1      -1.645  -2.702   0.252  1.00  0.00           H  
HETATM   21  H   UNL     1      -1.930  -0.803  -1.382  1.00  0.00           H  
HETATM   22  H   UNL     1      -4.287  -0.414  -1.704  1.00  0.00           H  
HETATM   23  H   UNL     1      -4.651  -0.653   0.039  1.00  0.00           H  
HETATM   24  H   UNL     1      -4.551   1.753  -0.098  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.238   1.711  -1.313  1.00  0.00           H  
CONECT    1   12   12    5                                            
CONECT    2    3    8    9   15                                       
CONECT    3   13   13    6    2                                       
CONECT    4   14    5    5    6                                       
CONECT    5    1    4    4   16                                       
CONECT    6    4    3   17                                            
CONECT    7    9   18   19   20                                       
CONECT    8    2   11                                                 
CONECT    9    2    7   10   21                                       
CONECT   10    9   11   22   23                                       
CONECT   11    8   10   24   25                                       
CONECT   12    1    1   14                                            
CONECT   13    3    3                                                 
CONECT   14   12    4                                                 
CONECT   15    2                                                      
CONECT   16    5                                                      
CONECT   17    6                                                      
CONECT   18    7                                                      
CONECT   19    7                                                      
CONECT   20    7                                                      
CONECT   21    9                                                      
CONECT   22   10                                                      
CONECT   23   10                                                      
CONECT   24   11                                                      
CONECT   25   11                                                      
MASTER        0    0    0    0    0    0    0    0   25    0   25    0
END
