COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  P   UNL     1       4.779  -3.756   0.229  1.00  0.00           P  
HETATM    2  O   UNL     1       4.240  -4.911  -0.524  1.00  0.00           O  
HETATM    3  O   UNL     1       3.630  -2.642   0.399  1.00  0.00           O  
HETATM    4  C   UNL     1       2.916  -2.085  -0.707  1.00  0.00           C  
HETATM    5  C   UNL     1       1.901  -1.061  -0.195  1.00  0.00           C  
HETATM    6  C   UNL     1       1.085  -0.479  -1.371  1.00  0.00           C  
HETATM    7  O   UNL     1      -0.177  -1.141  -1.481  1.00  0.00           O  
HETATM    8  C   UNL     1       0.890   1.006  -0.993  1.00  0.00           C  
HETATM    9  C   UNL     1       1.611   1.146   0.366  1.00  0.00           C  
HETATM   10  O   UNL     1       2.580   0.075   0.381  1.00  0.00           O  
HETATM   11  N   UNL     1       2.284   2.444   0.456  1.00  0.00           N  
HETATM   12  C   UNL     1       1.870   3.359   1.385  1.00  0.00           C  
HETATM   13  C   UNL     1       2.490   4.556   1.467  1.00  0.00           C  
HETATM   14  C   UNL     1       3.561   4.839   0.586  1.00  0.00           C  
HETATM   15  N   UNL     1       3.939   3.910  -0.316  1.00  0.00           N  
HETATM   16  C   UNL     1       3.306   2.724  -0.373  1.00  0.00           C  
HETATM   17  O   UNL     1       3.658   1.896  -1.191  1.00  0.00           O  
HETATM   18  O   UNL     1       4.136   5.911   0.641  1.00  0.00           O  
HETATM   19  O   UNL     1       5.271  -4.246   1.682  1.00  0.00           O  
HETATM   20  C   UNL     1      -0.576   1.326  -0.849  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.543   0.500  -0.389  1.00  0.00           C  
HETATM   22  N   UNL     1      -2.696   1.207  -0.435  1.00  0.00           N  
HETATM   23  N   UNL     1      -2.432   2.380  -0.894  1.00  0.00           N  
HETATM   24  N   UNL     1      -1.175   2.485  -1.145  1.00  0.00           N  
HETATM   25  C   UNL     1      -4.022   0.719  -0.032  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.658  -0.030  -1.204  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.041  -0.544  -0.799  1.00  0.00           C  
HETATM   28  N   UNL     1      -5.986  -1.324   0.425  1.00  0.00           N  
HETATM   29  C   UNL     1      -5.219  -0.823   1.551  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.866  -0.251   1.139  1.00  0.00           C  
HETATM   31  C   UNL     1      -7.023   0.623  -0.691  1.00  0.00           C  
HETATM   32  C   UNL     1      -6.541  -1.467  -1.932  1.00  0.00           C  
HETATM   33  C   UNL     1      -6.004   0.225   2.345  1.00  0.00           C  
HETATM   34  C   UNL     1      -4.949  -2.009   2.506  1.00  0.00           C  
HETATM   35  O   UNL     1      -5.715  -2.737   0.162  1.00  0.00           O  
HETATM   36  H   UNL     1       3.618  -1.595  -1.382  1.00  0.00           H  
HETATM   37  H   UNL     1       2.394  -2.880  -1.239  1.00  0.00           H  
HETATM   38  H   UNL     1       1.238  -1.519   0.539  1.00  0.00           H  
HETATM   39  H   UNL     1       1.643  -0.566  -2.303  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.110  -2.089  -1.658  1.00  0.00           H  
HETATM   41  H   UNL     1       1.350   1.654  -1.740  1.00  0.00           H  
HETATM   42  H   UNL     1       0.902   1.028   1.186  1.00  0.00           H  
HETATM   43  H   UNL     1       1.050   3.126   2.048  1.00  0.00           H  
HETATM   44  H   UNL     1       2.173   5.287   2.196  1.00  0.00           H  
HETATM   45  H   UNL     1       4.672   4.097  -0.923  1.00  0.00           H  
HETATM   46  H   UNL     1       5.965  -4.919   1.656  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.420  -0.519  -0.052  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.636   1.567   0.258  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.758   0.646  -2.055  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.025  -0.872  -1.485  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.201  -1.068   0.845  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.420   0.274   1.987  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.097   1.126  -1.655  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.005   0.246  -0.402  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.669   1.328   0.061  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.846  -2.298  -2.056  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.528  -1.854  -1.676  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.602  -0.901  -2.861  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.159   1.109   1.726  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.970  -0.188   2.637  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.442   0.501   3.238  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.402  -1.654   3.379  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.896  -2.444   2.822  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.357  -2.764   1.988  1.00  0.00           H  
HETATM   65  H   UNL     1      -5.672  -3.284   0.957  1.00  0.00           H  
HETATM   66  O   UNL     1       6.024  -3.125  -0.574  1.00  0.00           O  
HETATM   67  H   UNL     1       6.428  -2.363  -0.137  1.00  0.00           H  
CONECT    1    2    2    3   19                                       
CONECT    1   66                                                      
CONECT    2    1    1                                                 
CONECT    3    1    4                                                 
CONECT    4    3    5   36   37                                       
CONECT    5    6   10    4   38                                       
CONECT    6    8    7    5   39                                       
CONECT    7    6   40                                                 
CONECT    8    6   20    9   41                                       
CONECT    9    8   11   10   42                                       
CONECT   10    9    5                                                 
CONECT   11   16   12    9                                            
CONECT   12   13   13   11   43                                       
CONECT   13   14   12   12   44                                       
CONECT   14   18   18   13   15                                       
CONECT   15   14   16   45                                            
CONECT   16   15   11   17   17                                       
CONECT   17   16   16                                                 
CONECT   18   14   14                                                 
CONECT   19    1   46                                                 
CONECT   20   21   21    8   24                                       
CONECT   21   20   20   22   47                                       
CONECT   22   21   25   23                                            
CONECT   23   22   24   24                                            
CONECT   24   20   23   23                                            
CONECT   25   30   22   26   48                                       
CONECT   26   25   27   49   50                                       
CONECT   27   28   32   26   31                                       
CONECT   28   29   35   27                                            
CONECT   29   34   30   33   28                                       
CONECT   30   29   25   51   52                                       
CONECT   31   27   53   54   55                                       
CONECT   32   27   56   57   58                                       
CONECT   33   29   59   60   61                                       
CONECT   34   29   62   63   64                                       
CONECT   35   28   65                                                 
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   15                                                      
CONECT   46   19                                                      
CONECT   47   21                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   30                                                      
CONECT   52   30                                                      
CONECT   53   31                                                      
CONECT   54   31                                                      
CONECT   55   31                                                      
CONECT   56   32                                                      
CONECT   57   32                                                      
CONECT   58   32                                                      
CONECT   59   33                                                      
CONECT   60   33                                                      
CONECT   61   33                                                      
CONECT   62   34                                                      
CONECT   63   34                                                      
CONECT   64   34                                                      
CONECT   65   35                                                      
CONECT   66    1   67                                                 
CONECT   67   66                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
