COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       2.700  -0.753   0.036  1.00  0.00           N  
HETATM    2  N   UNL     1       4.642   0.602   0.001  1.00  0.00           N  
HETATM    3  C   UNL     1      -0.608   0.624  -0.029  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.434  -0.489   0.004  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.884  -1.760   0.049  1.00  0.00           C  
HETATM    6  C   UNL     1       3.278   0.402   0.000  1.00  0.00           C  
HETATM    7  C   UNL     1       1.076  -3.276   0.112  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.285   3.710   0.496  1.00  0.00           C  
HETATM    9  C   UNL     1       5.551  -0.545   0.045  1.00  0.00           C  
HETATM   10  C   UNL     1       5.362   2.486   1.384  1.00  0.00           C  
HETATM   11  C   UNL     1       0.503  -1.928   0.063  1.00  0.00           C  
HETATM   12  C   UNL     1       1.364  -0.788   0.029  1.00  0.00           C  
HETATM   13  C   UNL     1       0.783   0.479  -0.016  1.00  0.00           C  
HETATM   14  S   UNL     1       2.072   1.681  -0.050  1.00  0.00           S  
HETATM   15  I   UNL     1      -3.515  -0.249  -0.015  1.00  0.00           I  
HETATM   16  O   UNL     1      -1.697  -2.846   0.082  1.00  0.00           O  
HETATM   17  O   UNL     1       1.332  -3.857   1.302  1.00  0.00           O  
HETATM   18  O   UNL     1       1.319  -3.871  -0.920  1.00  0.00           O  
HETATM   19  N   UNL     1      -1.171   1.903  -0.076  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.927   2.477   0.907  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.732   3.907  -0.786  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.051   2.789  -1.109  1.00  0.00           C  
HETATM   23  C   UNL     1       5.182   1.963  -0.042  1.00  0.00           C  
HETATM   24  C   UNL     1       5.876  -0.994  -1.381  1.00  0.00           C  
HETATM   25  H   UNL     1      -2.890   4.417   1.046  1.00  0.00           H  
HETATM   26  H   UNL     1       6.472  -0.261   0.555  1.00  0.00           H  
HETATM   27  H   UNL     1       5.076  -1.365   0.584  1.00  0.00           H  
HETATM   28  H   UNL     1       4.398   2.494   1.893  1.00  0.00           H  
HETATM   29  H   UNL     1       6.053   1.838   1.924  1.00  0.00           H  
HETATM   30  H   UNL     1       5.764   3.499   1.352  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.928  -3.191  -0.792  1.00  0.00           H  
HETATM   32  H   UNL     1       1.710  -4.747   1.283  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.191   2.022   1.850  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.836   4.791  -1.397  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.511   2.620  -2.029  1.00  0.00           H  
HETATM   36  H   UNL     1       6.147   1.956  -0.551  1.00  0.00           H  
HETATM   37  H   UNL     1       4.492   2.611  -0.582  1.00  0.00           H  
HETATM   38  H   UNL     1       4.956  -1.279  -1.891  1.00  0.00           H  
HETATM   39  H   UNL     1       6.351  -0.175  -1.921  1.00  0.00           H  
HETATM   40  H   UNL     1       6.553  -1.848  -1.349  1.00  0.00           H  
CONECT    1    6    6   12                                            
CONECT    2    9   23    6                                            
CONECT    3   13   13    4   19                                       
CONECT    4    5    5    3   15                                       
CONECT    5   11   16    4    4                                       
CONECT    6    2    1    1   14                                       
CONECT    7   18   18   11   17                                       
CONECT    8   20   20   21   25                                       
CONECT    9   24    2   26   27                                       
CONECT   10   23   28   29   30                                       
CONECT   11    7   12   12    5                                       
CONECT   12    1   11   11   13                                       
CONECT   13   14   12    3    3                                       
CONECT   14    6   13                                                 
CONECT   15    4                                                      
CONECT   16    5   31                                                 
CONECT   17    7   32                                                 
CONECT   18    7    7                                                 
CONECT   19    3   20   22                                            
CONECT   20   19    8    8   33                                       
CONECT   21   22   22    8   34                                       
CONECT   22   19   21   21   35                                       
CONECT   23   10    2   36   37                                       
CONECT   24    9   38   39   40                                       
CONECT   25    8                                                      
CONECT   26    9                                                      
CONECT   27    9                                                      
CONECT   28   10                                                      
CONECT   29   10                                                      
CONECT   30   10                                                      
CONECT   31   16                                                      
CONECT   32   17                                                      
CONECT   33   20                                                      
CONECT   34   21                                                      
CONECT   35   22                                                      
CONECT   36   23                                                      
CONECT   37   23                                                      
CONECT   38   24                                                      
CONECT   39   24                                                      
CONECT   40   24                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
