COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  S   UNL     1      -5.478   0.752  -0.256  1.00  0.00           S  
HETATM    2  N   UNL     1      -6.570  -0.493  -0.266  1.00  0.00           N  
HETATM    3  O   UNL     1      -5.842   1.576   0.843  1.00  0.00           O  
HETATM    4  O   UNL     1      -5.371   1.183  -1.606  1.00  0.00           O  
HETATM    5  C   UNL     1      -3.907   0.071   0.155  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.514  -0.009   1.479  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.285  -0.547   1.805  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.438  -0.998   0.802  1.00  0.00           C  
HETATM    9  N   UNL     1      -0.189  -1.539   1.129  1.00  0.00           N  
HETATM   10  C   UNL     1       0.876  -1.301   0.339  1.00  0.00           C  
HETATM   11  O   UNL     1       0.779  -0.532  -0.598  1.00  0.00           O  
HETATM   12  N   UNL     1       2.050  -1.915   0.587  1.00  0.00           N  
HETATM   13  S   UNL     1       3.359  -1.622  -0.384  1.00  0.00           S  
HETATM   14  O   UNL     1       4.431  -2.368   0.177  1.00  0.00           O  
HETATM   15  O   UNL     1       2.885  -1.739  -1.718  1.00  0.00           O  
HETATM   16  C   UNL     1       3.798   0.072  -0.179  1.00  0.00           C  
HETATM   17  C   UNL     1       3.238   1.035  -0.997  1.00  0.00           C  
HETATM   18  C   UNL     1       3.580   2.365  -0.835  1.00  0.00           C  
HETATM   19  C   UNL     1       4.489   2.730   0.141  1.00  0.00           C  
HETATM   20  C   UNL     1       4.865   4.179   0.315  1.00  0.00           C  
HETATM   21  C   UNL     1       5.048   1.768   0.960  1.00  0.00           C  
HETATM   22  C   UNL     1       4.703   0.439   0.800  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.835  -0.917  -0.527  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.068  -0.383  -0.846  1.00  0.00           C  
HETATM   25  H   UNL     1      -6.278  -1.396  -0.065  1.00  0.00           H  
HETATM   26  H   UNL     1      -7.502  -0.319  -0.473  1.00  0.00           H  
HETATM   27  H   UNL     1      -4.172   0.346   2.259  1.00  0.00           H  
HETATM   28  H   UNL     1      -1.979  -0.609   2.839  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.091  -2.086   1.924  1.00  0.00           H  
HETATM   30  H   UNL     1       2.128  -2.528   1.334  1.00  0.00           H  
HETATM   31  H   UNL     1       2.531   0.749  -1.762  1.00  0.00           H  
HETATM   32  H   UNL     1       3.142   3.117  -1.474  1.00  0.00           H  
HETATM   33  H   UNL     1       5.727   4.409  -0.311  1.00  0.00           H  
HETATM   34  H   UNL     1       4.025   4.810   0.023  1.00  0.00           H  
HETATM   35  H   UNL     1       5.114   4.367   1.360  1.00  0.00           H  
HETATM   36  H   UNL     1       5.755   2.054   1.724  1.00  0.00           H  
HETATM   37  H   UNL     1       5.141  -0.314   1.439  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.180  -1.270  -1.309  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.377  -0.319  -1.879  1.00  0.00           H  
CONECT    1    2    3    3    4                                       
CONECT    1    4    5                                                 
CONECT    2    1   25   26                                            
CONECT    3    1    1                                                 
CONECT    4    1    1                                                 
CONECT    5    1    6   24   24                                       
CONECT    6    5    7    7   27                                       
CONECT    7    6    6    8   28                                       
CONECT    8    7    9   23   23                                       
CONECT    9    8   10   29                                            
CONECT   10    9   11   11   12                                       
CONECT   11   10   10                                                 
CONECT   12   10   13   30                                            
CONECT   13   12   14   14   15                                       
CONECT   13   15   16                                                 
CONECT   14   13   13                                                 
CONECT   15   13   13                                                 
CONECT   16   13   17   22   22                                       
CONECT   17   16   18   18   31                                       
CONECT   18   17   17   19   32                                       
CONECT   19   18   20   21   21                                       
CONECT   20   19   33   34   35                                       
CONECT   21   19   19   22   36                                       
CONECT   22   16   16   21   37                                       
CONECT   23    8    8   24   38                                       
CONECT   24    5    5   23   39                                       
CONECT   25    2                                                      
CONECT   26    2                                                      
CONECT   27    6                                                      
CONECT   28    7                                                      
CONECT   29    9                                                      
CONECT   30   12                                                      
CONECT   31   17                                                      
CONECT   32   18                                                      
CONECT   33   20                                                      
CONECT   34   20                                                      
CONECT   35   20                                                      
CONECT   36   21                                                      
CONECT   37   22                                                      
CONECT   38   23                                                      
CONECT   39   24                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
