COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1      -0.842   0.091   4.990  1.00  0.00           S  
HETATM    2  O   UNL     1      -1.025  -1.154   4.332  1.00  0.00           O  
HETATM    3  O   UNL     1      -1.727   0.652   5.950  1.00  0.00           O  
HETATM    4  O   UNL     1      -0.720   1.129   3.883  1.00  0.00           O  
HETATM    5  N   UNL     1       0.630  -0.007   5.741  1.00  0.00           N  
HETATM    6  N   UNL     1       1.046  -0.671  -1.861  1.00  0.00           N  
HETATM    7  N   UNL     1       2.273  -0.034  -2.091  1.00  0.00           N  
HETATM    8  N   UNL     1       4.334   0.537  -1.965  1.00  0.00           N  
HETATM    9  N   UNL     1       3.792   1.249  -2.888  1.00  0.00           N  
HETATM   10  N   UNL     1      -4.218   0.630  -5.847  1.00  0.00           N  
HETATM   11  C   UNL     1       3.443  -0.263  -1.448  1.00  0.00           C  
HETATM   12  C   UNL     1       2.531   0.931  -3.005  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.042  -0.402  -2.685  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.324  -1.241  -3.758  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.403  -0.981  -4.572  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.209   0.134  -4.326  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.920   0.978  -3.251  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.842   0.709  -2.437  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.330   0.410  -5.174  1.00  0.00           C  
HETATM   20  C   UNL     1       0.910  -1.620  -0.753  1.00  0.00           C  
HETATM   21  C   UNL     1       0.473  -0.884   0.487  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.872  -0.728   0.759  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.275  -0.054   1.896  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.326   0.465   2.765  1.00  0.00           C  
HETATM   25  C   UNL     1       1.023   0.312   2.486  1.00  0.00           C  
HETATM   26  C   UNL     1       1.420  -0.366   1.351  1.00  0.00           C  
HETATM   27  H   UNL     1       0.756  -0.621   6.481  1.00  0.00           H  
HETATM   28  H   UNL     1       1.367   0.544   5.437  1.00  0.00           H  
HETATM   29  H   UNL     1       3.608  -0.977  -0.654  1.00  0.00           H  
HETATM   30  H   UNL     1       1.824   1.362  -3.698  1.00  0.00           H  
HETATM   31  H   UNL     1       0.298  -2.103  -3.948  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.624  -1.635  -5.403  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.540   1.840  -3.057  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.618   1.360  -1.606  1.00  0.00           H  
HETATM   35  H   UNL     1       1.869  -2.105  -0.570  1.00  0.00           H  
HETATM   36  H   UNL     1       0.165  -2.373  -1.010  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.610  -1.133   0.082  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.327   0.067   2.108  1.00  0.00           H  
HETATM   39  H   UNL     1       1.763   0.717   3.161  1.00  0.00           H  
HETATM   40  H   UNL     1       2.472  -0.490   1.136  1.00  0.00           H  
CONECT    1    2    2    3    3                                       
CONECT    1    4    5                                                 
CONECT    2    1    1                                                 
CONECT    3    1    1                                                 
CONECT    4    1   24                                                 
CONECT    5    1   27   28                                            
CONECT    6    7   13   20                                            
CONECT    7    6   11   12                                            
CONECT    8    9   11   11                                            
CONECT    9    8   12   12                                            
CONECT   10   19   19   19                                            
CONECT   11    7    8    8   29                                       
CONECT   12    7    9    9   30                                       
CONECT   13    6   14   14   18                                       
CONECT   14   13   13   15   31                                       
CONECT   15   14   16   16   32                                       
CONECT   16   15   15   17   19                                       
CONECT   17   16   18   18   33                                       
CONECT   18   13   17   17   34                                       
CONECT   19   10   10   10   16                                       
CONECT   20    6   21   35   36                                       
CONECT   21   20   22   22   26                                       
CONECT   22   21   21   23   37                                       
CONECT   23   22   24   24   38                                       
CONECT   24    4   23   23   25                                       
CONECT   25   24   26   26   39                                       
CONECT   26   21   25   25   40                                       
CONECT   27    5                                                      
CONECT   28    5                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   14                                                      
CONECT   32   15                                                      
CONECT   33   17                                                      
CONECT   34   18                                                      
CONECT   35   20                                                      
CONECT   36   20                                                      
CONECT   37   22                                                      
CONECT   38   23                                                      
CONECT   39   25                                                      
CONECT   40   26                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
