COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1       0.507   2.285   4.270  1.00  0.00           P  
HETATM    2  O   UNL     1       0.214   3.394   5.205  1.00  0.00           O  
HETATM    3  O   UNL     1       1.494   1.230   4.981  1.00  0.00           O  
HETATM    4  O   UNL     1       1.211   2.870   2.946  1.00  0.00           O  
HETATM    5  N   UNL     1      -0.927   1.513   3.848  1.00  0.00           N  
HETATM    6  C   UNL     1      -0.568   0.429   2.924  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.262   0.644   1.604  1.00  0.00           C  
HETATM    8  O   UNL     1      -2.335   1.207   1.567  1.00  0.00           O  
HETATM    9  C   UNL     1      -1.004  -0.911   3.517  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.310  -1.125   4.838  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.898  -0.679   6.007  1.00  0.00           C  
HETATM   12  C   UNL     1       0.913  -1.767   4.878  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.264  -0.875   7.219  1.00  0.00           C  
HETATM   14  C   UNL     1       1.553  -1.960   6.087  1.00  0.00           C  
HETATM   15  C   UNL     1       0.963  -1.519   7.262  1.00  0.00           C  
HETATM   16  O   UNL     1       1.588  -1.712   8.453  1.00  0.00           O  
HETATM   17  C   UNL     1       2.813  -2.392   8.170  1.00  0.00           C  
HETATM   18  O   UNL     1      -4.469  -1.699  -1.237  1.00  0.00           O  
HETATM   19  C   UNL     1      -3.688  -0.577  -0.821  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.222  -0.813  -1.186  1.00  0.00           C  
HETATM   21  O   UNL     1      -2.075  -0.948  -2.619  1.00  0.00           O  
HETATM   22  C   UNL     1      -1.364   0.418  -0.820  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.689   0.209   0.463  1.00  0.00           N  
HETATM   24  C   UNL     1      -0.331   0.514  -1.964  1.00  0.00           C  
HETATM   25  O   UNL     1       0.996   0.377  -1.454  1.00  0.00           O  
HETATM   26  C   UNL     1      -0.684  -0.671  -2.889  1.00  0.00           C  
HETATM   27  N   UNL     1      -0.500  -0.295  -4.293  1.00  0.00           N  
HETATM   28  C   UNL     1      -1.441   0.257  -5.110  1.00  0.00           C  
HETATM   29  N   UNL     1      -0.938   0.463  -6.293  1.00  0.00           N  
HETATM   30  C   UNL     1       0.354   0.057  -6.309  1.00  0.00           C  
HETATM   31  C   UNL     1       1.370   0.035  -7.280  1.00  0.00           C  
HETATM   32  N   UNL     1       1.137   0.506  -8.560  1.00  0.00           N  
HETATM   33  C   UNL     1       2.392   0.339  -9.306  1.00  0.00           C  
HETATM   34  C   UNL     1       0.158  -0.402  -9.172  1.00  0.00           C  
HETATM   35  N   UNL     1       2.560  -0.447  -6.939  1.00  0.00           N  
HETATM   36  C   UNL     1       2.792  -0.899  -5.720  1.00  0.00           C  
HETATM   37  C   UNL     1       0.652  -0.428  -5.025  1.00  0.00           C  
HETATM   38  N   UNL     1       1.871  -0.898  -4.779  1.00  0.00           N  
HETATM   39  H   UNL     1       2.302   1.711   5.207  1.00  0.00           H  
HETATM   40  H   UNL     1       1.385   2.117   2.365  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.469   2.179   3.317  1.00  0.00           H  
HETATM   42  H   UNL     1       0.510   0.425   2.771  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.737  -1.715   2.832  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.083  -0.907   3.670  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.854  -0.178   5.973  1.00  0.00           H  
HETATM   46  H   UNL     1       1.370  -2.115   3.964  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.724  -0.526   8.132  1.00  0.00           H  
HETATM   48  H   UNL     1       2.509  -2.462   6.118  1.00  0.00           H  
HETATM   49  H   UNL     1       3.352  -2.570   9.101  1.00  0.00           H  
HETATM   50  H   UNL     1       2.596  -3.346   7.688  1.00  0.00           H  
HETATM   51  H   UNL     1       3.424  -1.780   7.507  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.385  -1.510  -0.988  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.778  -0.451   0.257  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.048   0.321  -1.323  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.843  -1.701  -0.681  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.980   1.316  -0.785  1.00  0.00           H  
HETATM   57  H   UNL     1       0.168  -0.240   0.493  1.00  0.00           H  
HETATM   58  H   UNL     1      -0.438   1.459  -2.497  1.00  0.00           H  
HETATM   59  H   UNL     1       1.595   0.445  -2.210  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.070  -1.538  -2.646  1.00  0.00           H  
HETATM   61  H   UNL     1      -2.455   0.489  -4.820  1.00  0.00           H  
HETATM   62  H   UNL     1       2.258   0.697 -10.327  1.00  0.00           H  
HETATM   63  H   UNL     1       3.182   0.911  -8.820  1.00  0.00           H  
HETATM   64  H   UNL     1       2.666  -0.715  -9.324  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.058  -0.071 -10.187  1.00  0.00           H  
HETATM   66  H   UNL     1       0.567  -1.412  -9.198  1.00  0.00           H  
HETATM   67  H   UNL     1      -0.759  -0.397  -8.584  1.00  0.00           H  
HETATM   68  H   UNL     1       3.773  -1.283  -5.485  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    1    5                                                      
CONECT    2    1    1                                                 
CONECT    3    1   39                                                 
CONECT    4    1   40                                                 
CONECT    5    1    6   41                                            
CONECT    6    5    7    9   42                                       
CONECT    7    6    8    8   23                                       
CONECT    8    7    7                                                 
CONECT    9    6   10   43   44                                       
CONECT   10    9   11   11   12                                       
CONECT   11   10   10   13   45                                       
CONECT   12   10   14   14   46                                       
CONECT   13   11   15   15   47                                       
CONECT   14   12   12   15   48                                       
CONECT   15   13   13   14   16                                       
CONECT   16   15   17                                                 
CONECT   17   16   49   50   51                                       
CONECT   18   19   52                                                 
CONECT   19   18   20   53   54                                       
CONECT   20   19   21   22   55                                       
CONECT   21   20   26                                                 
CONECT   22   20   23   24   56                                       
CONECT   23    7   22   57                                            
CONECT   24   22   25   26   58                                       
CONECT   25   24   59                                                 
CONECT   26   21   24   27   60                                       
CONECT   27   26   28   37                                            
CONECT   28   27   29   29   61                                       
CONECT   29   28   28   30                                            
CONECT   30   29   31   31   37                                       
CONECT   31   30   30   32   35                                       
CONECT   32   31   33   34                                            
CONECT   33   32   62   63   64                                       
CONECT   34   32   65   66   67                                       
CONECT   35   31   36   36                                            
CONECT   36   35   35   38   68                                       
CONECT   37   27   30   38   38                                       
CONECT   38   36   37   37                                            
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    5                                                      
CONECT   42    6                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45   11                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   14                                                      
CONECT   49   17                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   22                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   25                                                      
CONECT   60   26                                                      
CONECT   61   28                                                      
CONECT   62   33                                                      
CONECT   63   33                                                      
CONECT   64   33                                                      
CONECT   65   34                                                      
CONECT   66   34                                                      
CONECT   67   34                                                      
CONECT   68   36                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
