COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.197   0.513   0.454  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.710   0.314   0.054  1.00  0.00           C  
HETATM    3  C   UNL     1       5.424   1.145   0.334  1.00  0.00           C  
HETATM    4  C   UNL     1       6.521   0.445  -0.148  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.228  -0.906   0.218  1.00  0.00           C  
HETATM    6  C   UNL     1       7.855   1.133  -0.278  1.00  0.00           C  
HETATM    7  C   UNL     1       1.657  -0.759  -0.006  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.827  -0.786   0.036  1.00  0.00           C  
HETATM    9  C   UNL     1       0.425  -1.395   0.227  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.331  -1.632  -0.223  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.565  -1.029  -0.306  1.00  0.00           C  
HETATM   12  N   UNL     1       2.835  -1.465   0.219  1.00  0.00           N  
HETATM   13  N   UNL     1       1.729   0.484  -0.436  1.00  0.00           N  
HETATM   14  C   UNL     1       4.069  -0.823   0.095  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.941   0.452  -0.396  1.00  0.00           N  
HETATM   16  C   UNL     1       6.391  -0.883  -0.509  1.00  0.00           C  
HETATM   17  C   UNL     1       5.171  -1.519  -0.387  1.00  0.00           C  
HETATM   18  O   UNL     1       5.553   2.451   0.689  1.00  0.00           O  
HETATM   19  S   UNL     1       0.381   1.247  -0.684  1.00  0.00           S  
HETATM   20  O   UNL     1       0.445  -2.553   0.621  1.00  0.00           O  
HETATM   21  N   UNL     1      -1.981  -1.519   0.300  1.00  0.00           N  
HETATM   22  C   UNL     1      -4.600   1.042   0.491  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.368   0.433   0.572  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.032   0.964  -0.034  1.00  0.00           C  
HETATM   25  O   UNL     1      -7.156   2.133   0.274  1.00  0.00           O  
HETATM   26  N   UNL     1      -8.102   0.261  -0.456  1.00  0.00           N  
HETATM   27  H   UNL     1       3.342   1.056   0.829  1.00  0.00           H  
HETATM   28  H   UNL     1       7.938   1.583  -1.267  1.00  0.00           H  
HETATM   29  H   UNL     1       7.939   1.910   0.482  1.00  0.00           H  
HETATM   30  H   UNL     1       8.655   0.405  -0.142  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.218  -2.670  -0.501  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.420  -1.593  -0.648  1.00  0.00           H  
HETATM   33  H   UNL     1       2.799  -2.404   0.461  1.00  0.00           H  
HETATM   34  H   UNL     1       7.247  -1.425  -0.884  1.00  0.00           H  
HETATM   35  H   UNL     1       5.073  -2.556  -0.670  1.00  0.00           H  
HETATM   36  H   UNL     1       5.797   2.585   1.615  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.916  -2.456   0.542  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.708   2.081   0.765  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.511   0.994   0.913  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.003  -0.672  -0.702  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.971   0.688  -0.514  1.00  0.00           H  
CONECT    1    3    3   14   27                                       
CONECT    2   11   24   22   22                                       
CONECT    3    4   18    1    1                                       
CONECT    4    6   16   16    3                                       
CONECT    5   10   21   23   23                                       
CONECT    6    4   28   29   30                                       
CONECT    7   13   13   12    9                                       
CONECT    8   15   15    9   21                                       
CONECT    9    7    8   20   20                                       
CONECT   10   11   11    5   31                                       
CONECT   11   10   10    2   32                                       
CONECT   12   14    7   33                                            
CONECT   13   19    7    7                                            
CONECT   14   17   17    1   12                                       
CONECT   15   19    8    8                                            
CONECT   16    4    4   17   34                                       
CONECT   17   16   14   14   35                                       
CONECT   18    3   36                                                 
CONECT   19   13   15                                                 
CONECT   20    9    9                                                 
CONECT   21    8    5   37                                            
CONECT   22    2    2   23   38                                       
CONECT   23    5    5   22   39                                       
CONECT   24   26    2   25   25                                       
CONECT   25   24   24                                                 
CONECT   26   24   40   41                                            
CONECT   27    1                                                      
CONECT   28    6                                                      
CONECT   29    6                                                      
CONECT   30    6                                                      
CONECT   31   10                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   16                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   21                                                      
CONECT   38   22                                                      
CONECT   39   23                                                      
CONECT   40   26                                                      
CONECT   41   26                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
