COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.147  -0.900  -1.893  1.00  0.00           C  
HETATM    2  C   UNL     1       0.217  -1.643  -0.881  1.00  0.00           C  
HETATM    3  C   UNL     1       5.851   2.098  -0.964  1.00  0.00           C  
HETATM    4  C   UNL     1       5.809   0.778  -1.375  1.00  0.00           C  
HETATM    5  O   UNL     1      -5.984   0.062   1.434  1.00  0.00           O  
HETATM    6  C   UNL     1       5.151   2.494   0.160  1.00  0.00           C  
HETATM    7  O   UNL     1      -4.817   2.241   0.924  1.00  0.00           O  
HETATM    8  C   UNL     1       4.407   1.572   0.872  1.00  0.00           C  
HETATM    9  O   UNL     1      -3.309  -0.158   0.584  1.00  0.00           O  
HETATM   10  C   UNL     1       4.365   0.253   0.461  1.00  0.00           C  
HETATM   11  O   UNL     1      -5.164   0.408  -0.928  1.00  0.00           O  
HETATM   12  P   UNL     1      -5.803   1.089   0.383  1.00  0.00           P  
HETATM   13  O   UNL     1      -7.230   1.735   0.012  1.00  0.00           O  
HETATM   14  B   UNL     1      -3.897  -0.194  -0.708  1.00  0.00           B  
HETATM   15  N   UNL     1      -1.871  -1.437  -1.412  1.00  0.00           N  
HETATM   16  N   UNL     1      -1.684  -2.614  -0.926  1.00  0.00           N  
HETATM   17  N   UNL     1      -0.449  -2.768  -0.600  1.00  0.00           N  
HETATM   18  C   UNL     1      -0.688  -0.781  -1.403  1.00  0.00           C  
HETATM   19  C   UNL     1       1.684  -1.382  -0.655  1.00  0.00           C  
HETATM   20  N   UNL     1       1.893  -0.930   0.722  1.00  0.00           N  
HETATM   21  S   UNL     1       3.417  -0.923   1.369  1.00  0.00           S  
HETATM   22  O   UNL     1       3.979  -2.197   1.085  1.00  0.00           O  
HETATM   23  O   UNL     1       3.292  -0.406   2.687  1.00  0.00           O  
HETATM   24  C   UNL     1       5.066  -0.144  -0.662  1.00  0.00           C  
HETATM   25  C   UNL     1       6.667   3.102  -1.736  1.00  0.00           C  
HETATM   26  H   UNL     1      -3.761  -1.713  -2.279  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.960  -0.177  -2.687  1.00  0.00           H  
HETATM   28  H   UNL     1       6.357   0.468  -2.252  1.00  0.00           H  
HETATM   29  H   UNL     1       5.184   3.525   0.481  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.652   2.949   0.286  1.00  0.00           H  
HETATM   31  H   UNL     1       3.860   1.881   1.751  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.447  -0.593   0.636  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.674   2.163   0.757  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.502   0.227  -1.744  1.00  0.00           H  
HETATM   35  H   UNL     1       2.246  -2.300  -0.825  1.00  0.00           H  
HETATM   36  H   UNL     1       2.027  -0.613  -1.347  1.00  0.00           H  
HETATM   37  H   UNL     1       1.139  -0.633   1.255  1.00  0.00           H  
HETATM   38  H   UNL     1       5.032  -1.175  -0.984  1.00  0.00           H  
HETATM   39  H   UNL     1       6.048   3.553  -2.512  1.00  0.00           H  
HETATM   40  H   UNL     1       7.024   3.878  -1.059  1.00  0.00           H  
HETATM   41  H   UNL     1       7.518   2.601  -2.197  1.00  0.00           H  
CONECT    1   14   15   26   27                                       
CONECT    2   19   18   18   17                                       
CONECT    3    6   25    4    4                                       
CONECT    4    3    3   24   28                                       
CONECT    5   12   12                                                 
CONECT    6    8    8    3   29                                       
CONECT    7   12   30                                                 
CONECT    8    6    6   10   31                                       
CONECT    9   14   32                                                 
CONECT   10    8   21   24   24                                       
CONECT   11   12   14                                                 
CONECT   12    5    5   13    7                                       
CONECT   12   11                                                      
CONECT   13   12   33                                                 
CONECT   14   11    9    1                                            
CONECT   15   18    1   16                                            
CONECT   16   15   17   17                                            
CONECT   17    2   16   16                                            
CONECT   18    2    2   15   34                                       
CONECT   19   20    2   35   36                                       
CONECT   20   19   21   37                                            
CONECT   21   22   22   10   20                                       
CONECT   21   23   23                                                 
CONECT   22   21   21                                                 
CONECT   23   21   21                                                 
CONECT   24   10   10    4   38                                       
CONECT   25    3   39   40   41                                       
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    4                                                      
CONECT   29    6                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33   13                                                      
CONECT   34   18                                                      
CONECT   35   19                                                      
CONECT   36   19                                                      
CONECT   37   20                                                      
CONECT   38   24                                                      
CONECT   39   25                                                      
CONECT   40   25                                                      
CONECT   41   25                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
