COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  P   UNL     1       6.340  -1.886   0.755  1.00  0.00           P  
HETATM    2  O   UNL     1       7.181  -0.914   0.020  1.00  0.00           O  
HETATM    3  O   UNL     1       4.794  -1.455   0.638  1.00  0.00           O  
HETATM    4  C   UNL     1       4.138  -1.243  -0.614  1.00  0.00           C  
HETATM    5  C   UNL     1       2.681  -0.845  -0.365  1.00  0.00           C  
HETATM    6  C   UNL     1       1.919  -0.733  -1.704  1.00  0.00           C  
HETATM    7  O   UNL     1       1.172  -1.924  -1.957  1.00  0.00           O  
HETATM    8  C   UNL     1       0.969   0.468  -1.495  1.00  0.00           C  
HETATM    9  C   UNL     1       1.270   0.938  -0.055  1.00  0.00           C  
HETATM   10  O   UNL     1       2.612   0.477   0.211  1.00  0.00           O  
HETATM   11  N   UNL     1       1.207   2.400   0.028  1.00  0.00           N  
HETATM   12  C   UNL     1       2.111   3.157  -0.666  1.00  0.00           C  
HETATM   13  C   UNL     1       2.053   4.504  -0.590  1.00  0.00           C  
HETATM   14  C   UNL     1       1.052   5.106   0.211  1.00  0.00           C  
HETATM   15  N   UNL     1       0.180   4.325   0.879  1.00  0.00           N  
HETATM   16  C   UNL     1       0.257   2.984   0.781  1.00  0.00           C  
HETATM   17  O   UNL     1      -0.539   2.292   1.385  1.00  0.00           O  
HETATM   18  O   UNL     1       0.980   6.319   0.296  1.00  0.00           O  
HETATM   19  O   UNL     1       6.538  -3.353   0.122  1.00  0.00           O  
HETATM   20  C   UNL     1      -0.469   0.032  -1.619  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.986  -1.165  -1.255  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.306  -1.110  -1.548  1.00  0.00           N  
HETATM   23  N   UNL     1      -2.559   0.046  -2.053  1.00  0.00           N  
HETATM   24  N   UNL     1      -1.485   0.753  -2.104  1.00  0.00           N  
HETATM   25  H   UNL     1       4.644  -0.446  -1.159  1.00  0.00           H  
HETATM   26  H   UNL     1       4.169  -2.161  -1.201  1.00  0.00           H  
HETATM   27  H   UNL     1       2.197  -1.571   0.287  1.00  0.00           H  
HETATM   28  H   UNL     1       2.611  -0.534  -2.522  1.00  0.00           H  
HETATM   29  H   UNL     1       1.715  -2.720  -2.036  1.00  0.00           H  
HETATM   30  H   UNL     1       1.189   1.259  -2.212  1.00  0.00           H  
HETATM   31  H   UNL     1       0.566   0.489   0.646  1.00  0.00           H  
HETATM   32  H   UNL     1       2.867   2.680  -1.271  1.00  0.00           H  
HETATM   33  H   UNL     1       2.760   5.114  -1.132  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.508   4.730   1.429  1.00  0.00           H  
HETATM   35  H   UNL     1       6.016  -4.042   0.556  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.452  -1.997  -0.820  1.00  0.00           H  
HETATM   37  O   UNL     1       6.776  -1.907   2.305  1.00  0.00           O  
HETATM   38  C   UNL     1      -3.279  -2.182  -1.327  1.00  0.00           C  
HETATM   39  C   UNL     1      -4.421  -1.661  -0.493  1.00  0.00           C  
HETATM   40  C   UNL     1      -4.439  -1.593   1.017  1.00  0.00           C  
HETATM   41  N   UNL     1      -5.865  -1.422   1.385  1.00  0.00           N  
HETATM   42  C   UNL     1      -6.438  -0.771   0.184  1.00  0.00           C  
HETATM   43  C   UNL     1      -5.549  -1.190  -0.964  1.00  0.00           C  
HETATM   44  C   UNL     1      -7.871  -1.253  -0.048  1.00  0.00           C  
HETATM   45  C   UNL     1      -6.408   0.751   0.341  1.00  0.00           C  
HETATM   46  C   UNL     1      -3.889  -2.891   1.612  1.00  0.00           C  
HETATM   47  C   UNL     1      -3.619  -0.396   1.503  1.00  0.00           C  
HETATM   48  O   UNL     1      -6.003  -0.565   2.563  1.00  0.00           O  
HETATM   49  H   UNL     1       7.698  -2.159   2.451  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.660  -2.530  -2.287  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.797  -3.010  -0.806  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.806  -1.120  -2.011  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.483  -1.002   0.819  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.280  -0.766  -0.933  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.872  -2.333  -0.194  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.374   1.095   0.350  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.937   1.213  -0.493  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.892   1.029   1.277  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.864  -3.039   1.274  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.908  -2.828   2.700  1.00  0.00           H  
HETATM   61  H   UNL     1      -4.504  -3.729   1.286  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.971   0.510   1.011  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.734  -0.292   2.582  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.567  -0.555   1.264  1.00  0.00           H  
HETATM   65  H   UNL     1      -6.918  -0.425   2.842  1.00  0.00           H  
CONECT    1    3   19    2    2                                       
CONECT    1   37                                                      
CONECT    2    1    1                                                 
CONECT    3    1    4                                                 
CONECT    4    3    5   25   26                                       
CONECT    5   10    4    6   27                                       
CONECT    6    5    8    7   28                                       
CONECT    7    6   29                                                 
CONECT    8    9    6   20   30                                       
CONECT    9   10   11    8   31                                       
CONECT   10    5    9                                                 
CONECT   11    9   12   16                                            
CONECT   12   11   13   13   32                                       
CONECT   13   12   12   14   33                                       
CONECT   14   13   15   18   18                                       
CONECT   15   16   14   34                                            
CONECT   16   11   17   17   15                                       
CONECT   17   16   16                                                 
CONECT   18   14   14                                                 
CONECT   19    1   35                                                 
CONECT   20   24    8   21   21                                       
CONECT   21   20   20   22   36                                       
CONECT   22   23   21   38                                            
CONECT   23   24   24   22                                            
CONECT   24   23   23   20                                            
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    9                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   15                                                      
CONECT   35   19                                                      
CONECT   36   21                                                      
CONECT   37    1   49                                                 
CONECT   38   22   39   50   51                                       
CONECT   39   38   40   43   43                                       
CONECT   40   39   41   46   47                                       
CONECT   41   40   42   48                                            
CONECT   42   41   43   44   45                                       
CONECT   43   42   39   39   52                                       
CONECT   44   42   53   54   55                                       
CONECT   45   42   56   57   58                                       
CONECT   46   40   59   60   61                                       
CONECT   47   40   62   63   64                                       
CONECT   48   41   65                                                 
CONECT   49   37                                                      
CONECT   50   38                                                      
CONECT   51   38                                                      
CONECT   52   43                                                      
CONECT   53   44                                                      
CONECT   54   44                                                      
CONECT   55   44                                                      
CONECT   56   45                                                      
CONECT   57   45                                                      
CONECT   58   45                                                      
CONECT   59   46                                                      
CONECT   60   46                                                      
CONECT   61   46                                                      
CONECT   62   47                                                      
CONECT   63   47                                                      
CONECT   64   47                                                      
CONECT   65   48                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
