COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.497  -0.362  -1.036  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.584   0.421   1.396  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.607   1.301   0.243  1.00  0.00           C  
HETATM    4  C   UNL     1       5.554   1.803   0.658  1.00  0.00           C  
HETATM    5  C   UNL     1       5.427  -0.424  -0.285  1.00  0.00           C  
HETATM    6  C   UNL     1       3.472   1.006  -0.289  1.00  0.00           C  
HETATM    7  C   UNL     1       2.868   0.218  -1.453  1.00  0.00           C  
HETATM    8  C   UNL     1       1.340   0.298  -1.379  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.807  -0.582   0.143  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.733   0.249  -1.012  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.288   0.647   0.209  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.352  -0.196   1.355  1.00  0.00           C  
HETATM   13  C   UNL     1       1.493   0.472   1.138  1.00  0.00           C  
HETATM   14  C   UNL     1       3.020   0.390   1.037  1.00  0.00           C  
HETATM   15  N   UNL     1       4.938   0.959  -0.375  1.00  0.00           N  
HETATM   16  N   UNL     1       0.905  -0.158  -0.052  1.00  0.00           N  
HETATM   17  O   UNL     1      -0.027  -1.936   1.383  1.00  0.00           O  
HETATM   18  O   UNL     1      -0.179  -2.108  -1.105  1.00  0.00           O  
HETATM   19  S   UNL     1      -0.226  -1.358   0.100  1.00  0.00           S  
HETATM   20  H   UNL     1      -2.066  -0.666  -1.978  1.00  0.00           H  
HETATM   21  H   UNL     1      -4.008   0.722   2.342  1.00  0.00           H  
HETATM   22  H   UNL     1      -6.033   1.607   1.188  1.00  0.00           H  
HETATM   23  H   UNL     1       5.250   1.451   1.643  1.00  0.00           H  
HETATM   24  H   UNL     1       6.639   1.750   0.571  1.00  0.00           H  
HETATM   25  H   UNL     1       5.229   2.835   0.524  1.00  0.00           H  
HETATM   26  H   UNL     1       5.009  -1.010  -1.103  1.00  0.00           H  
HETATM   27  H   UNL     1       6.515  -0.430  -0.351  1.00  0.00           H  
HETATM   28  H   UNL     1       5.118  -0.856   0.667  1.00  0.00           H  
HETATM   29  H   UNL     1       3.139   2.043  -0.340  1.00  0.00           H  
HETATM   30  H   UNL     1       3.209   0.642  -2.397  1.00  0.00           H  
HETATM   31  H   UNL     1       3.181  -0.824  -1.388  1.00  0.00           H  
HETATM   32  H   UNL     1       1.020   1.328  -1.535  1.00  0.00           H  
HETATM   33  H   UNL     1       0.903  -0.340  -2.148  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.271   0.421  -1.933  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.807  -0.371   2.271  1.00  0.00           H  
HETATM   36  H   UNL     1       1.158  -0.053   2.033  1.00  0.00           H  
HETATM   37  H   UNL     1       1.186   1.517   1.188  1.00  0.00           H  
HETATM   38  H   UNL     1       3.331  -0.654   1.078  1.00  0.00           H  
HETATM   39  H   UNL     1       3.469   0.938   1.865  1.00  0.00           H  
HETATM   40  O   UNL     1      -6.214   1.495  -0.788  1.00  0.00           O  
CONECT    1   10    9    9   20                                       
CONECT    2   11   12   12   21                                       
CONECT    3   11   22   40   40                                       
CONECT    4   15   23   24   25                                       
CONECT    5   15   26   27   28                                       
CONECT    6   14   15    7   29                                       
CONECT    7    6    8   30   31                                       
CONECT    8   16    7   32   33                                       
CONECT    9    1    1   12   19                                       
CONECT   10   11   11    1   34                                       
CONECT   11    3   10   10    2                                       
CONECT   12    2    2    9   35                                       
CONECT   13   14   16   36   37                                       
CONECT   14   13    6   38   39                                       
CONECT   15    6    4    5                                            
CONECT   16   13   19    8                                            
CONECT   17   19   19                                                 
CONECT   18   19   19                                                 
CONECT   19    9   17   17   16                                       
CONECT   19   18   18                                                 
CONECT   20    1                                                      
CONECT   21    2                                                      
CONECT   22    3                                                      
CONECT   23    4                                                      
CONECT   24    4                                                      
CONECT   25    4                                                      
CONECT   26    5                                                      
CONECT   27    5                                                      
CONECT   28    5                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40    3    3                                                 
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
