COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.953   2.544  -1.269  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.988   1.618  -0.863  1.00  0.00           C  
HETATM    3  C   UNL     1       0.437   2.001  -0.831  1.00  0.00           C  
HETATM    4  C   UNL     1       2.781   1.487  -0.407  1.00  0.00           C  
HETATM    5  C   UNL     1       3.605   0.316   0.063  1.00  0.00           C  
HETATM    6  C   UNL     1       4.138  -0.630  -0.827  1.00  0.00           C  
HETATM    7  C   UNL     1       4.025  -0.684  -2.237  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.664   0.903  -0.912  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.282   2.185  -1.292  1.00  0.00           C  
HETATM   10  C   UNL     1       3.432   0.977   2.453  1.00  0.00           C  
HETATM   11  C   UNL     1       3.882   0.112   1.355  1.00  0.00           C  
HETATM   12  C   UNL     1       4.869  -1.631  -0.175  1.00  0.00           C  
HETATM   13  C   UNL     1       5.465  -2.655  -0.918  1.00  0.00           C  
HETATM   14  C   UNL     1       5.335  -2.681  -2.286  1.00  0.00           C  
HETATM   15  C   UNL     1       4.615  -1.688  -2.939  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.494  -0.323  -0.024  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.293  -1.696   0.881  1.00  0.00           C  
HETATM   18  C   UNL     1      -8.694  -1.430   1.435  1.00  0.00           C  
HETATM   19  C   UNL     1      -8.464  -2.586   0.459  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.705  -0.025  -0.518  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.375   0.329  -0.487  1.00  0.00           C  
HETATM   22  N   UNL     1       1.367   1.107  -0.439  1.00  0.00           N  
HETATM   23  N   UNL     1      -5.011   0.543  -0.936  1.00  0.00           N  
HETATM   24  N   UNL     1      -6.768  -0.754  -0.111  1.00  0.00           N  
HETATM   25  O   UNL     1       2.757   1.960   2.214  1.00  0.00           O  
HETATM   26  O   UNL     1       3.767   0.682   3.725  1.00  0.00           O  
HETATM   27  O   UNL     1       0.773   3.123  -1.157  1.00  0.00           O  
HETATM   28  O   UNL     1      -4.780  -0.716   0.879  1.00  0.00           O  
HETATM   29  S   UNL     1       4.858  -1.332   1.560  1.00  0.00           S  
HETATM   30  H   UNL     1      -1.657   3.541  -1.560  1.00  0.00           H  
HETATM   31  H   UNL     1       2.917   2.325   0.277  1.00  0.00           H  
HETATM   32  H   UNL     1       3.102   1.779  -1.407  1.00  0.00           H  
HETATM   33  H   UNL     1       3.466   0.078  -2.760  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.028   2.901  -1.605  1.00  0.00           H  
HETATM   35  H   UNL     1       6.029  -3.427  -0.416  1.00  0.00           H  
HETATM   36  H   UNL     1       5.797  -3.474  -2.856  1.00  0.00           H  
HETATM   37  H   UNL     1       4.520  -1.716  -4.014  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.555  -2.122   1.560  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.879  -1.682   2.479  1.00  0.00           H  
HETATM   40  H   UNL     1      -9.226  -0.555   1.061  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.843  -2.471  -0.556  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.496  -3.599   0.862  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.006  -1.019  -0.223  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.632  -0.389  -0.173  1.00  0.00           H  
HETATM   45  H   UNL     1       1.099   0.212  -0.178  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.601   0.917  -1.610  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.338  -0.440  -0.831  1.00  0.00           H  
HETATM   48  H   UNL     1       3.447   1.281   4.414  1.00  0.00           H  
CONECT    1    2    2    9   30                                       
CONECT    2    3    1    1   21                                       
CONECT    3   22   27   27    2                                       
CONECT    4    5   22   31   32                                       
CONECT    5    6    4   11   11                                       
CONECT    6    7    7    5   12                                       
CONECT    7   15    6    6   33                                       
CONECT    8    9    9   23   20                                       
CONECT    9    1    8    8   34                                       
CONECT   10   25   25   26   11                                       
CONECT   11   10   29    5    5                                       
CONECT   12   29   13   13    6                                       
CONECT   13   12   12   14   35                                       
CONECT   14   13   15   15   36                                       
CONECT   15   14   14    7   37                                       
CONECT   16   23   28   28   24                                       
CONECT   17   24   18   19   38                                       
CONECT   18   17   19   39   40                                       
CONECT   19   18   17   41   42                                       
CONECT   20    8   21   21   43                                       
CONECT   21   20   20    2   44                                       
CONECT   22    4    3   45                                            
CONECT   23   16    8   46                                            
CONECT   24   16   17   47                                            
CONECT   25   10   10                                                 
CONECT   26   10   48                                                 
CONECT   27    3    3                                                 
CONECT   28   16   16                                                 
CONECT   29   11   12                                                 
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    4                                                      
CONECT   33    7                                                      
CONECT   34    9                                                      
CONECT   35   13                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   26                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
