COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1      -5.870   2.431   0.129  1.00  0.00           P  
HETATM    2  O   UNL     1      -7.229   2.059  -0.324  1.00  0.00           O  
HETATM    3  O   UNL     1      -5.567   3.958  -0.282  1.00  0.00           O  
HETATM    4  O   UNL     1      -5.776   2.277   1.729  1.00  0.00           O  
HETATM    5  O   UNL     1      -4.788   1.464  -0.568  1.00  0.00           O  
HETATM    6  C   UNL     1      -4.849   0.038  -0.482  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.676  -0.570  -1.252  1.00  0.00           C  
HETATM    8  O   UNL     1      -2.438  -0.236  -0.601  1.00  0.00           O  
HETATM    9  C   UNL     1      -1.551  -1.361  -0.782  1.00  0.00           C  
HETATM   10  N   UNL     1      -0.494  -1.352   0.233  1.00  0.00           N  
HETATM   11  C   UNL     1       0.817  -1.410  -0.153  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.822  -1.282   1.536  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.993  -1.227   1.857  1.00  0.00           O  
HETATM   14  N   UNL     1       0.128  -1.273   2.489  1.00  0.00           N  
HETATM   15  C   UNL     1       1.432  -1.333   2.150  1.00  0.00           C  
HETATM   16  O   UNL     1       2.293  -1.325   3.011  1.00  0.00           O  
HETATM   17  C   UNL     1       1.791  -1.402   0.782  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.478  -2.588  -0.593  1.00  0.00           C  
HETATM   19  O   UNL     1      -1.954  -3.732  -1.271  1.00  0.00           O  
HETATM   20  C   UNL     1      -3.792  -2.106  -1.256  1.00  0.00           C  
HETATM   21  C   UNL     1       3.241  -1.465   0.375  1.00  0.00           C  
HETATM   22  N   UNL     1       3.789  -0.104   0.302  1.00  0.00           N  
HETATM   23  C   UNL     1       5.204  -0.127  -0.093  1.00  0.00           C  
HETATM   24  C   UNL     1       5.738   1.305  -0.159  1.00  0.00           C  
HETATM   25  S   UNL     1       7.485   1.277  -0.646  1.00  0.00           S  
HETATM   26  O   UNL     1       8.282   0.711   0.386  1.00  0.00           O  
HETATM   27  O   UNL     1       7.620   0.848  -1.994  1.00  0.00           O  
HETATM   28  O   UNL     1      -3.885  -2.597  -2.595  1.00  0.00           O  
HETATM   29  O   UNL     1       7.895   2.742  -0.675  1.00  0.00           O  
HETATM   30  H   UNL     1      -6.181   4.598   0.102  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.911   2.506   2.095  1.00  0.00           H  
HETATM   32  H   UNL     1       8.818   2.888  -0.923  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.794  -0.265   0.563  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.787  -0.312  -0.913  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.669  -0.194  -2.275  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.654  -2.426  -0.670  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.120  -1.352  -1.783  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.631  -2.801   0.465  1.00  0.00           H  
HETATM   39  H   UNL     1       1.072  -1.462  -1.202  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.125  -1.222   3.424  1.00  0.00           H  
HETATM   41  H   UNL     1       3.800  -2.043   1.112  1.00  0.00           H  
HETATM   42  H   UNL     1       3.324  -1.944  -0.600  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.500  -4.525  -1.183  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.961  -3.559  -2.657  1.00  0.00           H  
HETATM   45  H   UNL     1       3.248   0.470  -0.327  1.00  0.00           H  
HETATM   46  H   UNL     1       5.776  -0.695   0.641  1.00  0.00           H  
HETATM   47  H   UNL     1       5.300  -0.596  -1.072  1.00  0.00           H  
HETATM   48  H   UNL     1       5.166   1.873  -0.892  1.00  0.00           H  
HETATM   49  H   UNL     1       5.641   1.774   0.821  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    1    5                                                      
CONECT    2    1    1                                                 
CONECT    3    1   30                                                 
CONECT    4    1   31                                                 
CONECT    5    1    6                                                 
CONECT    6    5    7   33   34                                       
CONECT    7    6    8   20   35                                       
CONECT    8    7    9                                                 
CONECT    9    8   10   18   37                                       
CONECT   10    9   11   12                                            
CONECT   11   10   17   17   39                                       
CONECT   12   10   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   15   40                                            
CONECT   15   14   16   16   17                                       
CONECT   16   15   15                                                 
CONECT   17   11   11   15   21                                       
CONECT   18    9   19   20   38                                       
CONECT   19   18   43                                                 
CONECT   20    7   18   28   36                                       
CONECT   21   17   22   41   42                                       
CONECT   22   21   23   45                                            
CONECT   23   22   24   46   47                                       
CONECT   24   23   25   48   49                                       
CONECT   25   24   26   26   27                                       
CONECT   25   27   29                                                 
CONECT   26   25   25                                                 
CONECT   27   25   25                                                 
CONECT   28   20   44                                                 
CONECT   29   25   32                                                 
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32   29                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36   20                                                      
CONECT   37    9                                                      
CONECT   38   18                                                      
CONECT   39   11                                                      
CONECT   40   14                                                      
CONECT   41   21                                                      
CONECT   42   21                                                      
CONECT   43   19                                                      
CONECT   44   28                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
