COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1      -5.806  -2.255   0.342  1.00  0.00           P  
HETATM    2  S   UNL     1      -7.575  -1.701   0.150  1.00  0.00           S  
HETATM    3  O   UNL     1      -5.683  -3.224   1.622  1.00  0.00           O  
HETATM    4  O   UNL     1      -5.346  -3.052  -0.979  1.00  0.00           O  
HETATM    5  O   UNL     1      -4.860  -0.969   0.550  1.00  0.00           O  
HETATM    6  P   UNL     1      -4.537   0.336  -0.335  1.00  0.00           P  
HETATM    7  O   UNL     1      -4.425  -0.049  -1.760  1.00  0.00           O  
HETATM    8  O   UNL     1      -5.723   1.410  -0.161  1.00  0.00           O  
HETATM    9  O   UNL     1      -3.148   0.987   0.155  1.00  0.00           O  
HETATM   10  P   UNL     1      -2.137   2.070  -0.474  1.00  0.00           P  
HETATM   11  O   UNL     1      -2.009   1.839  -1.930  1.00  0.00           O  
HETATM   12  O   UNL     1      -2.710   3.553  -0.215  1.00  0.00           O  
HETATM   13  O   UNL     1      -0.692   1.924   0.222  1.00  0.00           O  
HETATM   14  C   UNL     1       0.451   2.676  -0.192  1.00  0.00           C  
HETATM   15  C   UNL     1       1.652   2.295   0.675  1.00  0.00           C  
HETATM   16  O   UNL     1       2.023   0.935   0.422  1.00  0.00           O  
HETATM   17  C   UNL     1       2.862   3.183   0.312  1.00  0.00           C  
HETATM   18  O   UNL     1       3.027   4.232   1.268  1.00  0.00           O  
HETATM   19  C   UNL     1       4.043   2.177   0.385  1.00  0.00           C  
HETATM   20  O   UNL     1       4.512   2.031   1.727  1.00  0.00           O  
HETATM   21  C   UNL     1       3.356   0.880  -0.111  1.00  0.00           C  
HETATM   22  N   UNL     1       4.061  -0.297   0.403  1.00  0.00           N  
HETATM   23  C   UNL     1       3.776  -0.969   1.556  1.00  0.00           C  
HETATM   24  N   UNL     1       4.601  -1.964   1.702  1.00  0.00           N  
HETATM   25  C   UNL     1       5.462  -1.990   0.655  1.00  0.00           C  
HETATM   26  C   UNL     1       6.543  -2.826   0.289  1.00  0.00           C  
HETATM   27  O   UNL     1       6.872  -3.766   0.992  1.00  0.00           O  
HETATM   28  N   UNL     1       7.203  -2.555  -0.859  1.00  0.00           N  
HETATM   29  C   UNL     1       6.827  -1.502  -1.637  1.00  0.00           C  
HETATM   30  N   UNL     1       7.516  -1.252  -2.798  1.00  0.00           N  
HETATM   31  N   UNL     1       5.825  -0.718  -1.309  1.00  0.00           N  
HETATM   32  C   UNL     1       5.121  -0.927  -0.190  1.00  0.00           C  
HETATM   33  H   UNL     1      -6.228  -4.021   1.566  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.434  -3.371  -0.949  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.853   1.708   0.750  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.820   3.774   0.720  1.00  0.00           H  
HETATM   37  H   UNL     1       0.672   2.455  -1.237  1.00  0.00           H  
HETATM   38  H   UNL     1       0.245   3.740  -0.082  1.00  0.00           H  
HETATM   39  H   UNL     1       1.403   2.421   1.728  1.00  0.00           H  
HETATM   40  H   UNL     1       2.757   3.590  -0.694  1.00  0.00           H  
HETATM   41  H   UNL     1       3.775   4.818   1.084  1.00  0.00           H  
HETATM   42  H   UNL     1       4.853   2.473  -0.282  1.00  0.00           H  
HETATM   43  H   UNL     1       4.853   2.848   2.116  1.00  0.00           H  
HETATM   44  H   UNL     1       3.327   0.860  -1.200  1.00  0.00           H  
HETATM   45  H   UNL     1       2.984  -0.713   2.244  1.00  0.00           H  
HETATM   46  H   UNL     1       7.949  -3.114  -1.130  1.00  0.00           H  
HETATM   47  H   UNL     1       8.258  -1.821  -3.053  1.00  0.00           H  
HETATM   48  H   UNL     1       7.260  -0.505  -3.362  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    1    5                                                      
CONECT    2    1    1                                                 
CONECT    3    1   33                                                 
CONECT    4    1   34                                                 
CONECT    5    1    6                                                 
CONECT    6    5    7    7    8                                       
CONECT    6    9                                                      
CONECT    7    6    6                                                 
CONECT    8    6   35                                                 
CONECT    9    6   10                                                 
CONECT   10    9   11   11   12                                       
CONECT   10   13                                                      
CONECT   11   10   10                                                 
CONECT   12   10   36                                                 
CONECT   13   10   14                                                 
CONECT   14   13   15   37   38                                       
CONECT   15   14   16   17   39                                       
CONECT   16   15   21                                                 
CONECT   17   15   18   19   40                                       
CONECT   18   17   41                                                 
CONECT   19   17   20   21   42                                       
CONECT   20   19   43                                                 
CONECT   21   16   19   22   44                                       
CONECT   22   21   23   32                                            
CONECT   23   22   24   24   45                                       
CONECT   24   23   23   25                                            
CONECT   25   24   26   32   32                                       
CONECT   26   25   27   27   28                                       
CONECT   27   26   26                                                 
CONECT   28   26   29   46                                            
CONECT   29   28   30   31   31                                       
CONECT   30   29   47   48                                            
CONECT   31   29   29   32                                            
CONECT   32   22   25   25   31                                       
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    8                                                      
CONECT   36   12                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   23                                                      
CONECT   46   28                                                      
CONECT   47   30                                                      
CONECT   48   30                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
