COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1      -2.363   0.912  -2.179  1.00  0.00           P  
HETATM    2  O   UNL     1      -3.351  -0.292  -2.584  1.00  0.00           O  
HETATM    3  O   UNL     1      -3.150   2.019  -1.592  1.00  0.00           O  
HETATM    4  P   UNL     1      -2.126  -0.122   0.178  1.00  0.00           P  
HETATM    5  O   UNL     1      -2.987   1.099   0.776  1.00  0.00           O  
HETATM    6  O   UNL     1      -3.038  -1.214  -0.231  1.00  0.00           O  
HETATM    7  O   UNL     1      -1.290   0.386  -1.100  1.00  0.00           O  
HETATM    8  O   UNL     1      -1.110  -0.665   1.303  1.00  0.00           O  
HETATM    9  C   UNL     1      -1.909  -1.099   2.405  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.999  -1.630   3.516  1.00  0.00           C  
HETATM   11  O   UNL     1      -0.122  -0.585   3.989  1.00  0.00           O  
HETATM   12  C   UNL     1      -1.834  -2.034   4.751  1.00  0.00           C  
HETATM   13  O   UNL     1      -2.066  -3.444   4.759  1.00  0.00           O  
HETATM   14  C   UNL     1      -0.952  -1.621   5.953  1.00  0.00           C  
HETATM   15  O   UNL     1      -0.614  -2.764   6.741  1.00  0.00           O  
HETATM   16  C   UNL     1       0.308  -1.014   5.299  1.00  0.00           C  
HETATM   17  N   UNL     1       0.786   0.129   6.079  1.00  0.00           N  
HETATM   18  C   UNL     1       0.395   1.426   5.931  1.00  0.00           C  
HETATM   19  N   UNL     1       1.020   2.180   6.788  1.00  0.00           N  
HETATM   20  C   UNL     1       1.846   1.416   7.543  1.00  0.00           C  
HETATM   21  C   UNL     1       2.749   1.672   8.588  1.00  0.00           C  
HETATM   22  N   UNL     1       2.930   2.957   9.069  1.00  0.00           N  
HETATM   23  N   UNL     1       3.422   0.650   9.108  1.00  0.00           N  
HETATM   24  C   UNL     1       3.256  -0.578   8.655  1.00  0.00           C  
HETATM   25  N   UNL     1       2.426  -0.864   7.674  1.00  0.00           N  
HETATM   26  C   UNL     1       1.710   0.091   7.093  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.489   1.508  -3.664  1.00  0.00           C  
HETATM   28  F   UNL     1      -2.422   1.964  -4.601  1.00  0.00           F  
HETATM   29  F   UNL     1      -0.631   2.555  -3.311  1.00  0.00           F  
HETATM   30  C   UNL     1      -0.675   0.363  -4.270  1.00  0.00           C  
HETATM   31  C   UNL     1       0.057   0.863  -5.516  1.00  0.00           C  
HETATM   32  C   UNL     1       0.871  -0.281  -6.123  1.00  0.00           C  
HETATM   33  C   UNL     1       1.604   0.219  -7.369  1.00  0.00           C  
HETATM   34  F   UNL     1       0.672   0.676  -8.307  1.00  0.00           F  
HETATM   35  F   UNL     1       2.463   1.266  -7.017  1.00  0.00           F  
HETATM   36  P   UNL     1       2.575  -1.144  -8.092  1.00  0.00           P  
HETATM   37  O   UNL     1       3.648  -1.670  -7.013  1.00  0.00           O  
HETATM   38  O   UNL     1       1.587  -2.349  -8.498  1.00  0.00           O  
HETATM   39  O   UNL     1       3.284  -0.660  -9.297  1.00  0.00           O  
HETATM   40  H   UNL     1      -2.799  -0.991  -2.962  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.357   1.787   1.030  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.581  -1.891   2.077  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.493  -0.260   2.784  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.418  -2.479   3.156  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.780  -1.492   4.766  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.589  -3.636   5.549  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.462  -0.875   6.562  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.446  -3.132   7.070  1.00  0.00           H  
HETATM   49  H   UNL     1       1.091  -1.768   5.213  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.327   1.777   5.209  1.00  0.00           H  
HETATM   51  H   UNL     1       3.553   3.120   9.794  1.00  0.00           H  
HETATM   52  H   UNL     1       2.435   3.694   8.679  1.00  0.00           H  
HETATM   53  H   UNL     1       3.824  -1.379   9.106  1.00  0.00           H  
HETATM   54  H   UNL     1       0.050   0.007  -3.540  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.344  -0.452  -4.545  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.668   1.219  -6.247  1.00  0.00           H  
HETATM   57  H   UNL     1       0.726   1.679  -5.242  1.00  0.00           H  
HETATM   58  H   UNL     1       1.598  -0.637  -5.392  1.00  0.00           H  
HETATM   59  H   UNL     1       0.203  -1.096  -6.398  1.00  0.00           H  
HETATM   60  H   UNL     1       4.138  -2.389  -7.434  1.00  0.00           H  
HETATM   61  H   UNL     1       1.146  -2.634  -7.686  1.00  0.00           H  
CONECT    1    2    3    3    7                                       
CONECT    1   27                                                      
CONECT    2    1   40                                                 
CONECT    3    1    1                                                 
CONECT    4    5    6    6    7                                       
CONECT    4    8                                                      
CONECT    5    4   41                                                 
CONECT    6    4    4                                                 
CONECT    7    1    4                                                 
CONECT    8    4    9                                                 
CONECT    9    8   10   42   43                                       
CONECT   10    9   11   12   44                                       
CONECT   11   10   16                                                 
CONECT   12   10   13   14   45                                       
CONECT   13   12   46                                                 
CONECT   14   12   15   16   47                                       
CONECT   15   14   48                                                 
CONECT   16   11   14   17   49                                       
CONECT   17   16   18   26                                            
CONECT   18   17   19   19   50                                       
CONECT   19   18   18   20                                            
CONECT   20   19   21   26   26                                       
CONECT   21   20   22   23   23                                       
CONECT   22   21   51   52                                            
CONECT   23   21   21   24                                            
CONECT   24   23   25   25   53                                       
CONECT   25   24   24   26                                            
CONECT   26   17   20   20   25                                       
CONECT   27    1   28   29   30                                       
CONECT   28   27                                                      
CONECT   29   27                                                      
CONECT   30   27   31   54   55                                       
CONECT   31   30   32   56   57                                       
CONECT   32   31   33   58   59                                       
CONECT   33   32   34   35   36                                       
CONECT   34   33                                                      
CONECT   35   33                                                      
CONECT   36   33   37   38   39                                       
CONECT   36   39                                                      
CONECT   37   36   60                                                 
CONECT   38   36   61                                                 
CONECT   39   36   36                                                 
CONECT   40    2                                                      
CONECT   41    5                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   12                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   18                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   24                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
CONECT   56   31                                                      
CONECT   57   31                                                      
CONECT   58   32                                                      
CONECT   59   32                                                      
CONECT   60   37                                                      
CONECT   61   38                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
