COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.627  -0.405   0.711  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.679  -1.048   1.333  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.651  -1.677   0.576  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.572  -1.664  -0.804  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.521  -1.022  -1.431  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.545  -0.390  -0.674  1.00  0.00           C  
HETATM    7  O   UNL     1      -4.511   0.242  -1.288  1.00  0.00           O  
HETATM    8  C   UNL     1      -3.572   0.837  -0.506  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.459   0.121  -0.090  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.722   2.164  -0.127  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.767   2.766   0.667  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.661   2.048   1.086  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.506   0.728   0.705  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.297  -0.049   1.158  1.00  0.00           C  
HETATM   15  C   UNL     1       0.826   0.112   0.132  1.00  0.00           C  
HETATM   16  C   UNL     1       2.054  -0.677   0.591  1.00  0.00           C  
HETATM   17  C   UNL     1       3.177  -0.517  -0.435  1.00  0.00           C  
HETATM   18  P   UNL     1       4.586  -1.574   0.036  1.00  0.00           P  
HETATM   19  O   UNL     1       5.768  -1.404  -1.044  1.00  0.00           O  
HETATM   20  O   UNL     1       5.122  -1.138   1.490  1.00  0.00           O  
HETATM   21  O   UNL     1       4.151  -2.988   0.073  1.00  0.00           O  
HETATM   22  S   UNL     1       3.710   1.217  -0.481  1.00  0.00           S  
HETATM   23  O   UNL     1       4.876   1.358  -1.281  1.00  0.00           O  
HETATM   24  O   UNL     1       2.593   2.078  -0.656  1.00  0.00           O  
HETATM   25  O   UNL     1       4.189   1.505   0.934  1.00  0.00           O  
HETATM   26  H   UNL     1      -4.871   0.090   1.303  1.00  0.00           H  
HETATM   27  H   UNL     1      -6.743  -1.060   2.411  1.00  0.00           H  
HETATM   28  H   UNL     1      -8.472  -2.180   1.064  1.00  0.00           H  
HETATM   29  H   UNL     1      -8.332  -2.156  -1.393  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.460  -1.013  -2.509  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.338  -0.910  -0.386  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.585   2.725  -0.454  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.883   3.798   0.962  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.915   2.521   1.707  1.00  0.00           H  
HETATM   35  H   UNL     1       0.037   0.329   2.124  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.557  -1.104   1.250  1.00  0.00           H  
HETATM   37  H   UNL     1       0.492  -0.266  -0.835  1.00  0.00           H  
HETATM   38  H   UNL     1       1.086   1.166   0.039  1.00  0.00           H  
HETATM   39  H   UNL     1       2.388  -0.299   1.558  1.00  0.00           H  
HETATM   40  H   UNL     1       1.794  -1.732   0.684  1.00  0.00           H  
HETATM   41  H   UNL     1       2.814  -0.812  -1.420  1.00  0.00           H  
HETATM   42  H   UNL     1       6.551  -1.939  -0.857  1.00  0.00           H  
HETATM   43  H   UNL     1       5.424  -0.221   1.539  1.00  0.00           H  
HETATM   44  H   UNL     1       4.509   2.408   1.065  1.00  0.00           H  
CONECT    1    2    2    6   26                                       
CONECT    2    1    1    3   27                                       
CONECT    3    2    4    4   28                                       
CONECT    4    3    3    5   29                                       
CONECT    5    4    6    6   30                                       
CONECT    6    1    5    5    7                                       
CONECT    7    6    8                                                 
CONECT    8    7    9    9   10                                       
CONECT    9    8    8   13   31                                       
CONECT   10    8   11   11   32                                       
CONECT   11   10   10   12   33                                       
CONECT   12   11   13   13   34                                       
CONECT   13    9   12   12   14                                       
CONECT   14   13   15   35   36                                       
CONECT   15   14   16   37   38                                       
CONECT   16   15   17   39   40                                       
CONECT   17   16   18   22   41                                       
CONECT   18   17   19   20   21                                       
CONECT   18   21                                                      
CONECT   19   18   42                                                 
CONECT   20   18   43                                                 
CONECT   21   18   18                                                 
CONECT   22   17   23   23   24                                       
CONECT   22   24   25                                                 
CONECT   23   22   22                                                 
CONECT   24   22   22                                                 
CONECT   25   22   44                                                 
CONECT   26    1                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   12                                                      
CONECT   35   14                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   25                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
