COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1       0.329  -0.491   0.514  1.00  0.00           P  
HETATM    2  O   UNL     1      -0.162  -1.833   0.901  1.00  0.00           O  
HETATM    3  O   UNL     1       0.540   0.404   1.836  1.00  0.00           O  
HETATM    4  O   UNL     1       1.730  -0.636  -0.265  1.00  0.00           O  
HETATM    5  P   UNL     1      -2.196  -0.024   0.216  1.00  0.00           P  
HETATM    6  O   UNL     1      -2.268  -1.400   0.755  1.00  0.00           O  
HETATM    7  O   UNL     1      -2.422   1.033   1.410  1.00  0.00           O  
HETATM    8  O   UNL     1      -0.750   0.218  -0.448  1.00  0.00           O  
HETATM    9  N   UNL     1       6.846   0.583  -0.085  1.00  0.00           N  
HETATM   10  C   UNL     1       8.127   0.817  -0.517  1.00  0.00           C  
HETATM   11  N   UNL     1       8.989   0.167  -1.291  1.00  0.00           N  
HETATM   12  C   UNL     1      10.185   0.664  -1.527  1.00  0.00           C  
HETATM   13  N   UNL     1      10.588   1.814  -1.020  1.00  0.00           N  
HETATM   14  C   UNL     1       9.794   2.535  -0.234  1.00  0.00           C  
HETATM   15  N   UNL     1      10.225   3.740   0.293  1.00  0.00           N  
HETATM   16  C   UNL     1       8.510   2.043   0.053  1.00  0.00           C  
HETATM   17  N   UNL     1       7.459   2.490   0.781  1.00  0.00           N  
HETATM   18  C   UNL     1       6.483   1.633   0.705  1.00  0.00           C  
HETATM   19  C   UNL     1       2.604  -1.374   0.592  1.00  0.00           C  
HETATM   20  C   UNL     1       3.962  -1.548  -0.093  1.00  0.00           C  
HETATM   21  O   UNL     1       4.620  -0.270  -0.237  1.00  0.00           O  
HETATM   22  C   UNL     1       6.019  -0.581  -0.413  1.00  0.00           C  
HETATM   23  C   UNL     1       6.298  -1.734   0.577  1.00  0.00           C  
HETATM   24  O   UNL     1       7.210  -2.678   0.012  1.00  0.00           O  
HETATM   25  C   UNL     1       4.911  -2.383   0.794  1.00  0.00           C  
HETATM   26  O   UNL     1       4.923  -3.747   0.368  1.00  0.00           O  
HETATM   27  O   UNL     1      -5.631  -3.697  -1.143  1.00  0.00           O  
HETATM   28  C   UNL     1      -5.017  -2.655  -0.382  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.276  -1.308  -1.059  1.00  0.00           C  
HETATM   30  O   UNL     1      -6.684  -0.983  -1.011  1.00  0.00           O  
HETATM   31  C   UNL     1      -6.754   0.447  -1.203  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.576   1.014  -0.379  1.00  0.00           C  
HETATM   33  C   UNL     1      -4.583  -0.166  -0.284  1.00  0.00           C  
HETATM   34  O   UNL     1      -3.339   0.176  -0.900  1.00  0.00           O  
HETATM   35  N   UNL     1      -8.026   0.970  -0.700  1.00  0.00           N  
HETATM   36  C   UNL     1      -8.787   1.783  -1.496  1.00  0.00           C  
HETATM   37  C   UNL     1      -8.438   0.643   0.538  1.00  0.00           C  
HETATM   38  O   UNL     1      -7.747  -0.080   1.229  1.00  0.00           O  
HETATM   39  N   UNL     1      -9.601   1.114   1.027  1.00  0.00           N  
HETATM   40  C   UNL     1     -10.380   1.917   0.274  1.00  0.00           C  
HETATM   41  O   UNL     1     -11.434   2.339   0.714  1.00  0.00           O  
HETATM   42  C   UNL     1      -9.960   2.264  -1.033  1.00  0.00           C  
HETATM   43  H   UNL     1       0.859   1.268   1.540  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.368   1.914   1.017  1.00  0.00           H  
HETATM   45  H   UNL     1      10.862   0.110  -2.161  1.00  0.00           H  
HETATM   46  H   UNL     1      11.115   4.067   0.091  1.00  0.00           H  
HETATM   47  H   UNL     1       9.635   4.259   0.862  1.00  0.00           H  
HETATM   48  H   UNL     1       5.526   1.739   1.194  1.00  0.00           H  
HETATM   49  H   UNL     1       2.172  -2.353   0.796  1.00  0.00           H  
HETATM   50  H   UNL     1       2.737  -0.832   1.528  1.00  0.00           H  
HETATM   51  H   UNL     1       3.836  -2.022  -1.067  1.00  0.00           H  
HETATM   52  H   UNL     1       6.210  -0.905  -1.436  1.00  0.00           H  
HETATM   53  H   UNL     1       6.688  -1.343   1.517  1.00  0.00           H  
HETATM   54  H   UNL     1       7.295  -3.400   0.650  1.00  0.00           H  
HETATM   55  H   UNL     1       4.615  -2.314   1.841  1.00  0.00           H  
HETATM   56  H   UNL     1       5.530  -4.218   0.955  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.445  -4.527  -0.683  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.943  -2.833  -0.325  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.437  -2.643   0.624  1.00  0.00           H  
HETATM   60  H   UNL     1      -4.927  -1.330  -2.092  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.632   0.695  -2.257  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.913   1.310   0.615  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.119   1.857  -0.896  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.426  -0.451   0.757  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.451   2.037  -2.490  1.00  0.00           H  
HETATM   66  H   UNL     1      -9.881   0.871   1.924  1.00  0.00           H  
HETATM   67  H   UNL     1     -10.570   2.907  -1.650  1.00  0.00           H  
CONECT    1    2    2    3    4                                       
CONECT    1    8                                                      
CONECT    2    1    1                                                 
CONECT    3    1   43                                                 
CONECT    4    1   19                                                 
CONECT    5    6    6    7    8                                       
CONECT    5   34                                                      
CONECT    6    5    5                                                 
CONECT    7    5   44                                                 
CONECT    8    1    5                                                 
CONECT    9   10   18   22                                            
CONECT   10    9   11   16   16                                       
CONECT   11   10   12   12                                            
CONECT   12   11   11   13   45                                       
CONECT   13   12   14   14                                            
CONECT   14   13   13   15   16                                       
CONECT   15   14   46   47                                            
CONECT   16   10   10   14   17                                       
CONECT   17   16   18   18                                            
CONECT   18    9   17   17   48                                       
CONECT   19    4   20   49   50                                       
CONECT   20   19   21   25   51                                       
CONECT   21   20   22                                                 
CONECT   22    9   21   23   52                                       
CONECT   23   22   24   25   53                                       
CONECT   24   23   54                                                 
CONECT   25   20   23   26   55                                       
CONECT   26   25   56                                                 
CONECT   27   28   57                                                 
CONECT   28   27   29   58   59                                       
CONECT   29   28   30   33   60                                       
CONECT   30   29   31                                                 
CONECT   31   30   32   35   61                                       
CONECT   32   31   33   62   63                                       
CONECT   33   29   32   34   64                                       
CONECT   34    5   33                                                 
CONECT   35   31   36   37                                            
CONECT   36   35   42   42   65                                       
CONECT   37   35   38   38   39                                       
CONECT   38   37   37                                                 
CONECT   39   37   40   66                                            
CONECT   40   39   41   41   42                                       
CONECT   41   40   40                                                 
CONECT   42   36   36   40   67                                       
CONECT   43    3                                                      
CONECT   44    7                                                      
CONECT   45   12                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   18                                                      
CONECT   49   19                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   31                                                      
CONECT   62   32                                                      
CONECT   63   32                                                      
CONECT   64   33                                                      
CONECT   65   36                                                      
CONECT   66   39                                                      
CONECT   67   42                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
