COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.776  -1.442   0.652  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.618  -0.072   0.482  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.073   2.420   0.098  1.00  0.00           C  
HETATM    4  C   UNL     1       1.110   1.536   0.034  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.372   0.565   1.044  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.465   2.770   0.546  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.470   2.137  -0.416  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.589   0.656  -0.168  1.00  0.00           C  
HETATM    9  O   UNL     1       0.016   3.581  -0.250  1.00  0.00           O  
HETATM   10  C   UNL     1       1.932   1.545  -1.095  1.00  0.00           C  
HETATM   11  C   UNL     1       3.034   0.718  -1.149  1.00  0.00           C  
HETATM   12  C   UNL     1       1.414   0.692   1.103  1.00  0.00           C  
HETATM   13  C   UNL     1       2.520  -0.131   1.036  1.00  0.00           C  
HETATM   14  C   UNL     1       3.327  -0.120  -0.088  1.00  0.00           C  
HETATM   15  S   UNL     1       4.736  -1.174  -0.165  1.00  0.00           S  
HETATM   16  N   UNL     1       6.014  -0.331   0.467  1.00  0.00           N  
HETATM   17  O   UNL     1       4.483  -2.249   0.729  1.00  0.00           O  
HETATM   18  O   UNL     1       5.022  -1.362  -1.544  1.00  0.00           O  
HETATM   19  N   UNL     1      -1.250   1.938   0.543  1.00  0.00           N  
HETATM   20  C   UNL     1      -4.730   0.016  -0.637  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.894  -1.346  -0.466  1.00  0.00           C  
HETATM   22  O   UNL     1      -6.015  -1.963  -0.928  1.00  0.00           O  
HETATM   23  C   UNL     1      -3.907  -2.083   0.182  1.00  0.00           C  
HETATM   24  O   UNL     1      -4.054  -3.424   0.352  1.00  0.00           O  
HETATM   25  H   UNL     1      -2.006  -2.012   1.151  1.00  0.00           H  
HETATM   26  H   UNL     1      -1.432   0.581   2.132  1.00  0.00           H  
HETATM   27  H   UNL     1      -0.500  -0.011   0.738  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.222   3.779   0.213  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.887   2.804   1.550  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.445   2.603  -0.274  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.139   2.303  -1.441  1.00  0.00           H  
HETATM   32  H   UNL     1       1.704   2.199  -1.924  1.00  0.00           H  
HETATM   33  H   UNL     1       3.671   0.725  -2.022  1.00  0.00           H  
HETATM   34  H   UNL     1       0.785   0.683   1.981  1.00  0.00           H  
HETATM   35  H   UNL     1       2.756  -0.784   1.863  1.00  0.00           H  
HETATM   36  H   UNL     1       6.733  -0.804   0.914  1.00  0.00           H  
HETATM   37  H   UNL     1       6.043   0.635   0.389  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.496   0.588  -1.140  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.939  -2.287  -1.836  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.499  -3.670   1.174  1.00  0.00           H  
CONECT    1   23   23    2   25                                       
CONECT    2    1    5    8    8                                       
CONECT    3    9    9   19    4                                       
CONECT    4    3   10   10   12                                       
CONECT    5    2   19   26   27                                       
CONECT    6   19    7   28   29                                       
CONECT    7    8    6   30   31                                       
CONECT    8    2    2   20    7                                       
CONECT    9    3    3                                                 
CONECT   10    4    4   11   32                                       
CONECT   11   10   14   14   33                                       
CONECT   12    4   13   13   34                                       
CONECT   13   12   12   14   35                                       
CONECT   14   11   11   13   15                                       
CONECT   15   14   16   17   17                                       
CONECT   15   18   18                                                 
CONECT   16   15   36   37                                            
CONECT   17   15   15                                                 
CONECT   18   15   15                                                 
CONECT   19    5    3    6                                            
CONECT   20   21   21    8   38                                       
CONECT   21   23   22   20   20                                       
CONECT   22   21   39                                                 
CONECT   23   24    1    1   21                                       
CONECT   24   23   40                                                 
CONECT   25    1                                                      
CONECT   26    5                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   13                                                      
CONECT   36   16                                                      
CONECT   37   16                                                      
CONECT   38   20                                                      
CONECT   39   22                                                      
CONECT   40   24                                                      
MASTER        0    0    0    0    0    0    0    0   40    0   40    0
END
