COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -4.064   0.197  -1.492  1.00  0.00           N  
HETATM    2  C   UNL     1       0.332   0.762   0.035  1.00  0.00           C  
HETATM    3  C   UNL     1       0.621  -0.606   0.020  1.00  0.00           C  
HETATM    4  C   UNL     1       1.943  -1.047  -0.001  1.00  0.00           C  
HETATM    5  C   UNL     1       2.976  -0.131  -0.007  1.00  0.00           C  
HETATM    6  C   UNL     1       5.283   0.445  -0.032  1.00  0.00           C  
HETATM    7  O   UNL     1      -3.855   1.418   0.643  1.00  0.00           O  
HETATM    8  O   UNL     1      -4.037  -1.074   0.624  1.00  0.00           O  
HETATM    9  S   UNL     1      -3.553   0.147   0.083  1.00  0.00           S  
HETATM   10  C   UNL     1      -1.796   0.020   0.057  1.00  0.00           C  
HETATM   11  N   UNL     1      -0.992   1.015   0.055  1.00  0.00           N  
HETATM   12  S   UNL     1      -0.901  -1.493   0.032  1.00  0.00           S  
HETATM   13  C   UNL     1       2.694   1.233   0.009  1.00  0.00           C  
HETATM   14  C   UNL     1       1.408   1.676   0.034  1.00  0.00           C  
HETATM   15  O   UNL     1       4.266  -0.559  -0.027  1.00  0.00           O  
HETATM   16  C   UNL     1       6.659  -0.222  -0.055  1.00  0.00           C  
HETATM   17  H   UNL     1      -3.417   0.155  -2.213  1.00  0.00           H  
HETATM   18  H   UNL     1      -5.011   0.263  -1.692  1.00  0.00           H  
HETATM   19  H   UNL     1       2.160  -2.105  -0.013  1.00  0.00           H  
HETATM   20  H   UNL     1       5.169   1.074  -0.915  1.00  0.00           H  
HETATM   21  H   UNL     1       5.192   1.059   0.865  1.00  0.00           H  
HETATM   22  H   UNL     1       3.505   1.946   0.004  1.00  0.00           H  
HETATM   23  H   UNL     1       1.208   2.737   0.046  1.00  0.00           H  
HETATM   24  H   UNL     1       7.435   0.543  -0.058  1.00  0.00           H  
HETATM   25  H   UNL     1       6.773  -0.851   0.829  1.00  0.00           H  
HETATM   26  H   UNL     1       6.751  -0.836  -0.951  1.00  0.00           H  
CONECT    1    9   17   18                                            
CONECT    2    3    3   11   14                                       
CONECT    3    2    2    4   12                                       
CONECT    4    3    5    5   19                                       
CONECT    5    4    4   13   15                                       
CONECT    6   15   16   20   21                                       
CONECT    7    9    9                                                 
CONECT    8    9    9                                                 
CONECT    9    1    7    7    8                                       
CONECT    9    8   10                                                 
CONECT   10    9   11   11   12                                       
CONECT   11    2   10   10                                            
CONECT   12    3   10                                                 
CONECT   13    5   14   14   22                                       
CONECT   14    2   13   13   23                                       
CONECT   15    5    6                                                 
CONECT   16    6   24   25   26                                       
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19    4                                                      
CONECT   20    6                                                      
CONECT   21    6                                                      
CONECT   22   13                                                      
CONECT   23   14                                                      
CONECT   24   16                                                      
CONECT   25   16                                                      
CONECT   26   16                                                      
MASTER        0    0    0    0    0    0    0    0   26    0   26    0
END
