COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.498  -2.194  -2.621  1.00  0.00           O  
HETATM    2  O   UNL     1       5.439   0.005   0.507  1.00  0.00           O  
HETATM    3  C   UNL     1       1.876   2.761   0.348  1.00  0.00           C  
HETATM    4  C   UNL     1       1.549  -1.126  -1.116  1.00  0.00           C  
HETATM    5  C   UNL     1       3.080   0.731  -0.504  1.00  0.00           C  
HETATM    6  C   UNL     1       1.825   1.411  -0.035  1.00  0.00           C  
HETATM    7  N   UNL     1       0.565  -0.561  -0.349  1.00  0.00           N  
HETATM    8  C   UNL     1       2.756  -0.547  -1.223  1.00  0.00           C  
HETATM    9  C   UNL     1       0.650   0.752   0.025  1.00  0.00           C  
HETATM   10  C   UNL     1       3.746  -1.157  -2.033  1.00  0.00           C  
HETATM   11  O   UNL     1       3.423  -0.431   1.872  1.00  0.00           O  
HETATM   12  C   UNL     1      -0.584  -1.367   0.073  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.636  -1.464   1.613  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.145  -1.414   1.942  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.826  -1.292   0.561  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.044  -0.370   0.646  1.00  0.00           C  
HETATM   17  O   UNL     1      -6.622   0.170  -2.350  1.00  0.00           O  
HETATM   18  O   UNL     1       4.310   1.702   1.623  1.00  0.00           O  
HETATM   19  O   UNL     1      -5.706   2.070  -0.782  1.00  0.00           O  
HETATM   20  O   UNL     1      -0.068  -2.698   2.057  1.00  0.00           O  
HETATM   21  O   UNL     1      -7.081   0.161   0.132  1.00  0.00           O  
HETATM   22  O   UNL     1      -2.555  -2.615   2.598  1.00  0.00           O  
HETATM   23  O   UNL     1      -1.818  -0.715  -0.298  1.00  0.00           O  
HETATM   24  O   UNL     1      -4.725  -0.363  -0.609  1.00  0.00           O  
HETATM   25  P   UNL     1      -6.056   0.502  -0.880  1.00  0.00           P  
HETATM   26  S   UNL     1       4.129   0.361   0.928  1.00  0.00           S  
HETATM   27  S   UNL     1       5.336  -0.415  -2.188  1.00  0.00           S  
HETATM   28  S   UNL     1       0.456   3.553   0.886  1.00  0.00           S  
HETATM   29  H   UNL     1       2.812   3.298   0.308  1.00  0.00           H  
HETATM   30  H   UNL     1       1.353  -2.051  -1.638  1.00  0.00           H  
HETATM   31  H   UNL     1       3.617   1.397  -1.181  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.234   1.266   0.373  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.532  -2.362  -0.370  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.118  -0.619   2.067  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.373  -0.544   2.558  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.121  -2.276   0.195  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.718  -0.730   1.424  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.718   0.641   0.889  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.425   0.656  -2.582  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.040   2.365  -1.417  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.075  -2.812   3.017  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.112  -2.772   3.443  1.00  0.00           H  
HETATM   43  H   UNL     1       5.955  -1.339  -3.054  1.00  0.00           H  
HETATM   44  H   UNL     1       4.858   1.662   2.420  1.00  0.00           H  
CONECT    1   10   10                                                 
CONECT    2   26   26                                                 
CONECT    3    6   28   28   29                                       
CONECT    4    7    8    8   30                                       
CONECT    5   26    8    6   31                                       
CONECT    6    5    9    9    3                                       
CONECT    7   12    4    9                                            
CONECT    8   10    4    4    5                                       
CONECT    9    7    6    6   32                                       
CONECT   10    1    1    8   27                                       
CONECT   11   26   26                                                 
CONECT   12   13    7   23   33                                       
CONECT   13   20   12   14   34                                       
CONECT   14   22   13   15   35                                       
CONECT   15   14   23   16   36                                       
CONECT   16   15   24   37   38                                       
CONECT   17   25   39                                                 
CONECT   18   26   44                                                 
CONECT   19   25   40                                                 
CONECT   20   13   41                                                 
CONECT   21   25   25                                                 
CONECT   22   14   42                                                 
CONECT   23   12   15                                                 
CONECT   24   25   16                                                 
CONECT   25   21   21   19   24                                       
CONECT   25   17                                                      
CONECT   26    2    2   11   11                                       
CONECT   26   18    5                                                 
CONECT   27   10   43                                                 
CONECT   28    3    3                                                 
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    9                                                      
CONECT   33   12                                                      
CONECT   34   13                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   22                                                      
CONECT   43   27                                                      
CONECT   44   18                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
