COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.040  -0.867  -1.648  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.032  -0.213  -0.265  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.809  -0.724   0.033  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.193  -0.171   0.257  1.00  0.00           C  
HETATM    5  C   UNL     1       1.096   0.783  -0.187  1.00  0.00           C  
HETATM    6  C   UNL     1       3.540   1.224   0.142  1.00  0.00           C  
HETATM    7  C   UNL     1       4.695   0.239   0.409  1.00  0.00           C  
HETATM    8  C   UNL     1       2.725  -0.916   0.218  1.00  0.00           C  
HETATM    9  N   UNL     1       2.355   0.359   0.043  1.00  0.00           N  
HETATM   10  N   UNL     1       4.037  -1.076   0.432  1.00  0.00           N  
HETATM   11  O   UNL     1      -4.354   1.019   0.388  1.00  0.00           O  
HETATM   12  O   UNL     1      -5.246  -1.001   0.310  1.00  0.00           O  
HETATM   13  O   UNL     1       0.871   1.966  -0.331  1.00  0.00           O  
HETATM   14  O   UNL     1       1.940  -1.844   0.185  1.00  0.00           O  
HETATM   15  S   UNL     1      -1.610   0.637   0.011  1.00  0.00           S  
HETATM   16  H   UNL     1       0.909  -1.378  -1.814  1.00  0.00           H  
HETATM   17  H   UNL     1      -0.855  -1.588  -1.705  1.00  0.00           H  
HETATM   18  H   UNL     1      -0.178  -0.101  -2.411  1.00  0.00           H  
HETATM   19  H   UNL     1       0.106  -0.979   0.498  1.00  0.00           H  
HETATM   20  H   UNL     1      -2.559  -1.415   0.838  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.778  -1.251  -0.921  1.00  0.00           H  
HETATM   22  H   UNL     1       3.435   1.924   0.972  1.00  0.00           H  
HETATM   23  H   UNL     1       3.704   1.761  -0.792  1.00  0.00           H  
HETATM   24  H   UNL     1       5.430   0.285  -0.394  1.00  0.00           H  
HETATM   25  H   UNL     1       5.163   0.449   1.371  1.00  0.00           H  
HETATM   26  H   UNL     1       4.483  -1.925   0.579  1.00  0.00           H  
HETATM   27  H   UNL     1      -6.114  -0.600   0.455  1.00  0.00           H  
CONECT    1    2   16   17   18                                       
CONECT    2   15    1    5   19                                       
CONECT    3   15    4   20   21                                       
CONECT    4    3   11   11   12                                       
CONECT    5   13   13    2    9                                       
CONECT    6    9    7   22   23                                       
CONECT    7    6   10   24   25                                       
CONECT    8    9   14   14   10                                       
CONECT    9    5    6    8                                            
CONECT   10    8    7   26                                            
CONECT   11    4    4                                                 
CONECT   12    4   27                                                 
CONECT   13    5    5                                                 
CONECT   14    8    8                                                 
CONECT   15    3    2                                                 
CONECT   16    1                                                      
CONECT   17    1                                                      
CONECT   18    1                                                      
CONECT   19    2                                                      
CONECT   20    3                                                      
CONECT   21    3                                                      
CONECT   22    6                                                      
CONECT   23    6                                                      
CONECT   24    7                                                      
CONECT   25    7                                                      
CONECT   26   10                                                      
CONECT   27   12                                                      
MASTER        0    0    0    0    0    0    0    0   27    0   27    0
END
