COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1       6.899  -1.826   0.380  1.00  0.00           P  
HETATM    2  O   UNL     1       7.430  -0.613  -0.281  1.00  0.00           O  
HETATM    3  O   UNL     1       5.290  -1.814   0.312  1.00  0.00           O  
HETATM    4  C   UNL     1       4.564  -1.689  -0.913  1.00  0.00           C  
HETATM    5  C   UNL     1       3.063  -1.713  -0.620  1.00  0.00           C  
HETATM    6  C   UNL     1       2.257  -1.666  -1.937  1.00  0.00           C  
HETATM    7  O   UNL     1       1.837  -2.979  -2.314  1.00  0.00           O  
HETATM    8  C   UNL     1       1.035  -0.783  -1.599  1.00  0.00           C  
HETATM    9  C   UNL     1       1.247  -0.401  -0.117  1.00  0.00           C  
HETATM   10  O   UNL     1       2.671  -0.522   0.097  1.00  0.00           O  
HETATM   11  N   UNL     1       0.810   0.977   0.122  1.00  0.00           N  
HETATM   12  C   UNL     1       1.360   2.108  -0.424  1.00  0.00           C  
HETATM   13  C   UNL     1       0.625   3.184   0.083  1.00  0.00           C  
HETATM   14  N   UNL     1      -0.328   2.673   0.904  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.226   1.370   0.925  1.00  0.00           C  
HETATM   16  N   UNL     1       2.373   2.337  -1.268  1.00  0.00           N  
HETATM   17  C   UNL     1       2.692   3.559  -1.632  1.00  0.00           C  
HETATM   18  N   UNL     1       3.739   3.744  -2.501  1.00  0.00           N  
HETATM   19  N   UNL     1       2.012   4.647  -1.172  1.00  0.00           N  
HETATM   20  C   UNL     1       0.977   4.494  -0.317  1.00  0.00           C  
HETATM   21  O   UNL     1       0.363   5.461   0.101  1.00  0.00           O  
HETATM   22  O   UNL     1       7.458  -3.135  -0.371  1.00  0.00           O  
HETATM   23  N   UNL     1      -1.037   0.516   1.658  1.00  0.00           N  
HETATM   24  C   UNL     1      -0.621   0.050   2.852  1.00  0.00           C  
HETATM   25  C   UNL     1       0.645   0.586   3.470  1.00  0.00           C  
HETATM   26  O   UNL     1      -1.265  -0.800   3.430  1.00  0.00           O  
HETATM   27  C   UNL     1      -2.248   0.149   1.173  1.00  0.00           C  
HETATM   28  C   UNL     1      -3.258   1.106   1.111  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.517   0.777   0.615  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.751  -0.605   0.158  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.653  -1.586   0.241  1.00  0.00           C  
HETATM   32  C   UNL     1      -2.428  -1.165   0.752  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.916  -0.957  -0.314  1.00  0.00           C  
HETATM   34  C   UNL     1      -6.150  -2.339  -0.770  1.00  0.00           C  
HETATM   35  C   UNL     1      -5.117  -3.269  -0.694  1.00  0.00           C  
HETATM   36  C   UNL     1      -3.868  -2.892  -0.190  1.00  0.00           C  
HETATM   37  C   UNL     1      -7.014   0.024  -0.396  1.00  0.00           C  
HETATM   38  C   UNL     1      -6.799   1.331   0.033  1.00  0.00           C  
HETATM   39  C   UNL     1      -5.550   1.707   0.539  1.00  0.00           C  
HETATM   40  C   UNL     1      -7.411  -2.668  -1.264  1.00  0.00           C  
HETATM   41  C   UNL     1      -8.421  -1.712  -1.325  1.00  0.00           C  
HETATM   42  C   UNL     1      -8.241  -0.397  -0.905  1.00  0.00           C  
HETATM   43  H   UNL     1       4.825  -0.747  -1.395  1.00  0.00           H  
HETATM   44  H   UNL     1       4.819  -2.518  -1.572  1.00  0.00           H  
HETATM   45  H   UNL     1       2.803  -2.604  -0.047  1.00  0.00           H  
HETATM   46  H   UNL     1       2.850  -1.213  -2.731  1.00  0.00           H  
HETATM   47  H   UNL     1       1.327  -3.008  -3.135  1.00  0.00           H  
HETATM   48  H   UNL     1       1.023   0.109  -2.225  1.00  0.00           H  
HETATM   49  H   UNL     1       0.111  -1.347  -1.722  1.00  0.00           H  
HETATM   50  H   UNL     1       0.707  -1.089   0.533  1.00  0.00           H  
HETATM   51  H   UNL     1       4.232   2.980  -2.837  1.00  0.00           H  
HETATM   52  H   UNL     1       3.986   4.641  -2.778  1.00  0.00           H  
HETATM   53  H   UNL     1       2.273   5.536  -1.460  1.00  0.00           H  
HETATM   54  H   UNL     1       7.150  -3.969   0.009  1.00  0.00           H  
HETATM   55  H   UNL     1       0.424   1.507   4.010  1.00  0.00           H  
HETATM   56  H   UNL     1       1.051  -0.152   4.162  1.00  0.00           H  
HETATM   57  H   UNL     1       1.374   0.789   2.686  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.063   2.112   1.451  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.607  -1.865   0.818  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.281  -4.284  -1.026  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.069  -3.616  -0.134  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.598   2.055  -0.024  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.387   2.722   0.872  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.606  -3.674  -1.604  1.00  0.00           H  
HETATM   65  H   UNL     1      -9.385  -2.003  -1.714  1.00  0.00           H  
HETATM   66  H   UNL     1      -9.060   0.303  -0.975  1.00  0.00           H  
HETATM   67  O   UNL     1       7.371  -1.849   1.920  1.00  0.00           O  
HETATM   68  H   UNL     1       8.330  -1.857   2.037  1.00  0.00           H  
CONECT    1    3   22    2    2                                       
CONECT    1   67                                                      
CONECT    2    1    1                                                 
CONECT    3    4    1                                                 
CONECT    4    5    3   43   44                                       
CONECT    5   10    6    4   45                                       
CONECT    6    8    5    7   46                                       
CONECT    7    6   47                                                 
CONECT    8    9    6   48   49                                       
CONECT    9   11    8   10   50                                       
CONECT   10    9    5                                                 
CONECT   11   15   12    9                                            
CONECT   12   13   13   11   16                                       
CONECT   13   14   20   12   12                                       
CONECT   14   15   15   13                                            
CONECT   15   23   14   14   11                                       
CONECT   16   12   17   17                                            
CONECT   17   19   16   16   18                                       
CONECT   18   17   51   52                                            
CONECT   19   20   17   53                                            
CONECT   20   21   21   13   19                                       
CONECT   21   20   20                                                 
CONECT   22    1   54                                                 
CONECT   23   27   24   15                                            
CONECT   24   25   23   26   26                                       
CONECT   25   24   55   56   57                                       
CONECT   26   24   24                                                 
CONECT   27   28   28   32   23                                       
CONECT   28   29   27   27   58                                       
CONECT   29   39   39   30   28                                       
CONECT   30   33   33   29   31                                       
CONECT   31   30   36   32   32                                       
CONECT   32   31   31   27   59                                       
CONECT   33   37   34   30   30                                       
CONECT   34   40   40   33   35                                       
CONECT   35   34   36   36   60                                       
CONECT   36   35   35   31   61                                       
CONECT   37   42   38   38   33                                       
CONECT   38   37   37   39   62                                       
CONECT   39   38   29   29   63                                       
CONECT   40   41   34   34   64                                       
CONECT   41   42   42   40   65                                       
CONECT   42   41   41   37   66                                       
CONECT   43    4                                                      
CONECT   44    4                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    8                                                      
CONECT   49    8                                                      
CONECT   50    9                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   22                                                      
CONECT   55   25                                                      
CONECT   56   25                                                      
CONECT   57   25                                                      
CONECT   58   28                                                      
CONECT   59   32                                                      
CONECT   60   35                                                      
CONECT   61   36                                                      
CONECT   62   38                                                      
CONECT   63   39                                                      
CONECT   64   40                                                      
CONECT   65   41                                                      
CONECT   66   42                                                      
CONECT   67    1   68                                                 
CONECT   68   67                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
