COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.326  -0.961   1.210  1.00  0.00           C  
HETATM    2  C   UNL     1       0.897   2.707   0.746  1.00  0.00           C  
HETATM    3  C   UNL     1       3.754  -1.079   0.630  1.00  0.00           C  
HETATM    4  C   UNL     1       5.090  -0.781   0.775  1.00  0.00           C  
HETATM    5  C   UNL     1       5.821  -0.303  -0.316  1.00  0.00           C  
HETATM    6  C   UNL     1       3.853  -0.423  -1.689  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.593   0.893  -0.388  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.700   1.338  -0.997  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.739  -1.105  -0.100  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.385  -2.430   0.936  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.731  -1.269   0.763  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.445   1.737  -0.238  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.505   2.428  -0.116  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.325   3.296   0.038  1.00  0.00           C  
HETATM   15  C   UNL     1       0.034   3.754   1.453  1.00  0.00           C  
HETATM   16  C   UNL     1       0.923  -0.991   0.273  1.00  0.00           C  
HETATM   17  C   UNL     1       3.131  -0.904  -0.601  1.00  0.00           C  
HETATM   18  C   UNL     1       5.191  -0.128  -1.552  1.00  0.00           C  
HETATM   19  C   UNL     1       7.211   0.009  -0.169  1.00  0.00           C  
HETATM   20  N   UNL     1      -3.591  -0.403   0.096  1.00  0.00           N  
HETATM   21  N   UNL     1      -4.609  -2.310   0.403  1.00  0.00           N  
HETATM   22  N   UNL     1      -0.397  -1.201   0.103  1.00  0.00           N  
HETATM   23  N   UNL     1       1.777  -1.212  -0.746  1.00  0.00           N  
HETATM   24  N   UNL     1       8.313   0.256  -0.052  1.00  0.00           N  
HETATM   25  O   UNL     1       1.344  -0.603   1.345  1.00  0.00           O  
HETATM   26  S   UNL     1      -5.842  -0.017  -0.956  1.00  0.00           S  
HETATM   27  H   UNL     1      -1.263   0.083   1.518  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.063  -1.604   2.050  1.00  0.00           H  
HETATM   29  H   UNL     1       0.828   1.677   1.097  1.00  0.00           H  
HETATM   30  H   UNL     1       1.880   3.019   0.394  1.00  0.00           H  
HETATM   31  H   UNL     1       3.190  -1.454   1.471  1.00  0.00           H  
HETATM   32  H   UNL     1       5.574  -0.918   1.731  1.00  0.00           H  
HETATM   33  H   UNL     1       3.366  -0.288  -2.643  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.863   2.317  -1.423  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.990  -3.310   1.421  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.146   3.995  -0.779  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.602   3.414   2.270  1.00  0.00           H  
HETATM   38  H   UNL     1       0.451   4.755   1.567  1.00  0.00           H  
HETATM   39  H   UNL     1       5.752   0.243  -2.397  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.733  -1.511  -0.753  1.00  0.00           H  
HETATM   41  H   UNL     1       1.451  -1.585  -1.580  1.00  0.00           H  
CONECT    1   22   11   27   28                                       
CONECT    2   15   14   29   30                                       
CONECT    3    4   17   17   31                                       
CONECT    4    5    5    3   32                                       
CONECT    5   19    4    4   18                                       
CONECT    6   18   18   17   33                                       
CONECT    7   20   12    8    8                                       
CONECT    8    7    7   26   34                                       
CONECT    9   21   21   20   26                                       
CONECT   10   11   11   21   35                                       
CONECT   11    1   10   10   20                                       
CONECT   12   13   13   13    7                                       
CONECT   13   14   12   12   12                                       
CONECT   14    2   15   13   36                                       
CONECT   15    2   14   37   38                                       
CONECT   16   23   25   25   22                                       
CONECT   17    3    3    6   23                                       
CONECT   18    5    6    6   39                                       
CONECT   19   24   24   24    5                                       
CONECT   20   11    9    7                                            
CONECT   21   10    9    9                                            
CONECT   22   16    1   40                                            
CONECT   23   17   16   41                                            
CONECT   24   19   19   19                                            
CONECT   25   16   16                                                 
CONECT   26    9    8                                                 
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   18                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
