COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.901   0.103   0.019  1.00  0.00           C  
HETATM    2  N   UNL     1      -5.223  -0.482   1.374  1.00  0.00           N  
HETATM    3  O   UNL     1      -5.249   0.727  -0.777  1.00  0.00           O  
HETATM    4  S   UNL     1      -4.591  -0.366  -0.152  1.00  0.00           S  
HETATM    5  C   UNL     1      -1.923  -0.869   0.129  1.00  0.00           C  
HETATM    6  O   UNL     1      -4.590  -1.683  -0.687  1.00  0.00           O  
HETATM    7  C   UNL     1      -0.597  -0.505   0.262  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.247   0.839   0.287  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.231   1.812   0.176  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.555   1.441   0.037  1.00  0.00           C  
HETATM   11  N   UNL     1       1.095   1.211   0.422  1.00  0.00           N  
HETATM   12  C   UNL     1       2.065   0.444  -0.114  1.00  0.00           C  
HETATM   13  O   UNL     1       1.771  -0.518  -0.797  1.00  0.00           O  
HETATM   14  N   UNL     1       3.360   0.743   0.107  1.00  0.00           N  
HETATM   15  C   UNL     1       4.414  -0.091  -0.475  1.00  0.00           C  
HETATM   16  C   UNL     1       5.707   0.728  -0.635  1.00  0.00           C  
HETATM   17  C   UNL     1       6.781   0.028   0.223  1.00  0.00           C  
HETATM   18  C   UNL     1       6.281  -1.434   0.339  1.00  0.00           C  
HETATM   19  C   UNL     1       4.748  -1.261   0.473  1.00  0.00           C  
HETATM   20  H   UNL     1       4.094  -0.475  -1.444  1.00  0.00           H  
HETATM   21  H   UNL     1       6.014   0.742  -1.680  1.00  0.00           H  
HETATM   22  H   UNL     1       5.550   1.746  -0.278  1.00  0.00           H  
HETATM   23  H   UNL     1      -6.153  -0.732   1.496  1.00  0.00           H  
HETATM   24  H   UNL     1      -2.196  -1.914   0.110  1.00  0.00           H  
HETATM   25  H   UNL     1       7.750   0.061  -0.276  1.00  0.00           H  
HETATM   26  H   UNL     1       6.844   0.491   1.208  1.00  0.00           H  
HETATM   27  H   UNL     1       0.166  -1.264   0.349  1.00  0.00           H  
HETATM   28  H   UNL     1       6.532  -2.000  -0.558  1.00  0.00           H  
HETATM   29  H   UNL     1       6.695  -1.914   1.225  1.00  0.00           H  
HETATM   30  H   UNL     1       4.481  -1.008   1.500  1.00  0.00           H  
HETATM   31  H   UNL     1       4.233  -2.168   0.157  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.962   2.858   0.195  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.320   2.198  -0.049  1.00  0.00           H  
HETATM   34  H   UNL     1       1.327   2.021   0.902  1.00  0.00           H  
HETATM   35  H   UNL     1       3.595   1.510   0.652  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.665  -0.301   2.146  1.00  0.00           H  
CONECT    1    5    5   10    4                                       
CONECT    2   23    4   36                                            
CONECT    3    4    4                                                 
CONECT    4    1    2    3    3                                       
CONECT    4    6    6                                                 
CONECT    5    1    1    7   24                                       
CONECT    6    4    4                                                 
CONECT    7    5   27    8    8                                       
CONECT    8    7    7   11    9                                       
CONECT    9    8   32   10   10                                       
CONECT   10    1    9    9   33                                       
CONECT   11    8   12   34                                            
CONECT   12   11   14   13   13                                       
CONECT   13   12   12                                                 
CONECT   14   12   35   15                                            
CONECT   15   14   19   20   16                                       
CONECT   16   15   22   17   21                                       
CONECT   17   16   18   25   26                                       
CONECT   18   17   19   28   29                                       
CONECT   19   15   18   30   31                                       
CONECT   20   15                                                      
CONECT   21   16                                                      
CONECT   22   16                                                      
CONECT   23    2                                                      
CONECT   24    5                                                      
CONECT   25   17                                                      
CONECT   26   17                                                      
CONECT   27    7                                                      
CONECT   28   18                                                      
CONECT   29   18                                                      
CONECT   30   19                                                      
CONECT   31   19                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   14                                                      
CONECT   36    2                                                      
MASTER        0    0    0    0    0    0    0    0   36    0   36    0
END
