COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       9.571  -0.292   1.554  1.00  0.00           C  
HETATM    2  C   UNL     1       8.458  -0.404   2.366  1.00  0.00           C  
HETATM    3  C   UNL     1       7.228  -0.711   1.815  1.00  0.00           C  
HETATM    4  C   UNL     1       5.771  -1.242  -0.150  1.00  0.00           C  
HETATM    5  C   UNL     1       3.862  -0.142  -1.067  1.00  0.00           C  
HETATM    6  C   UNL     1       1.841   0.821  -2.029  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.015   1.045  -0.432  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.187   0.145  -0.727  1.00  0.00           C  
HETATM    9  O   UNL     1       3.385  -1.245  -1.243  1.00  0.00           O  
HETATM   10  C   UNL     1      -2.465   2.506  -0.494  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.453   2.784   0.641  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.727   2.681   1.985  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.440  -2.739   1.453  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.365  -0.614   0.913  1.00  0.00           C  
HETATM   15  C   UNL     1       7.112  -0.907   0.451  1.00  0.00           C  
HETATM   16  P   UNL     1       0.567   0.973  -0.734  1.00  0.00           P  
HETATM   17  O   UNL     1       0.779  -0.184   0.365  1.00  0.00           O  
HETATM   18  O   UNL     1       0.680   2.298  -0.084  1.00  0.00           O  
HETATM   19  N   UNL     1      -0.959   0.816  -1.427  1.00  0.00           N  
HETATM   20  C   UNL     1      -4.032   4.191   0.481  1.00  0.00           C  
HETATM   21  O   UNL     1      -3.324  -0.328  -1.835  1.00  0.00           O  
HETATM   22  N   UNL     1      -4.083  -0.133   0.240  1.00  0.00           N  
HETATM   23  CA  UNL     1      -5.267  -0.938  -0.068  1.00  0.00           C  
HETATM   24  O   UNL     1      -6.176   0.205   1.781  1.00  0.00           O  
HETATM   25  OXT UNL     1      -7.551  -1.235   0.822  1.00  0.00           O  
HETATM   26  C   UNL     1      -4.915  -2.424   0.033  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.801  -2.753  -0.962  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.152  -3.264  -0.289  1.00  0.00           C  
HETATM   29  C   UNL     1       8.225  -0.794  -0.361  1.00  0.00           C  
HETATM   30  C   UNL     1       9.453  -0.482   0.190  1.00  0.00           C  
HETATM   31  O   UNL     1       5.083  -0.016  -0.512  1.00  0.00           O  
HETATM   32  N   UNL     1       3.169   0.957  -1.426  1.00  0.00           N  
HETATM   33  H   UNL     1      10.532  -0.052   1.985  1.00  0.00           H  
HETATM   34  H   UNL     1       8.549  -0.251   3.431  1.00  0.00           H  
HETATM   35  H   UNL     1       6.359  -0.799   2.449  1.00  0.00           H  
HETATM   36  H   UNL     1       5.915  -1.855  -1.040  1.00  0.00           H  
HETATM   37  H   UNL     1       5.174  -1.793   0.577  1.00  0.00           H  
HETATM   38  H   UNL     1       1.758  -0.155  -2.508  1.00  0.00           H  
HETATM   39  H   UNL     1       1.698   1.604  -2.774  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.630   0.826   0.564  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.598   3.158  -0.389  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.949   2.697  -1.451  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.260   2.052   0.608  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.444   2.811   2.796  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.256   1.702   2.070  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.965   3.458   2.046  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.558  -2.141   1.683  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.233  -2.505   2.162  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.189  -3.798   1.525  1.00  0.00           H  
HETATM   50  H   UNL     1       0.718  -1.081   0.009  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.065  -0.086  -1.866  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.224   4.922   0.515  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.549   4.264  -0.476  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.735   4.389   1.290  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.943   0.199   1.141  1.00  0.00           H  
HETATM   56  HA  UNL     1      -5.606  -0.714  -1.079  1.00  0.00           H  
HETATM   57  HXT UNL     1      -8.224  -0.994   1.474  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.550  -3.811  -0.890  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.140  -2.528  -1.974  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.920  -2.154  -0.733  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.946  -3.030   0.421  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.491  -3.040  -1.300  1.00  0.00           H  
HETATM   63  H   UNL     1      -5.901  -4.323  -0.216  1.00  0.00           H  
HETATM   64  H   UNL     1       8.133  -0.942  -1.427  1.00  0.00           H  
HETATM   65  H   UNL     1      10.323  -0.394  -0.444  1.00  0.00           H  
HETATM   66  H   UNL     1       3.550   1.838  -1.286  1.00  0.00           H  
CONECT    1   30    2    2   33                                       
CONECT    2    1    1    3   34                                       
CONECT    3   15   15    2   35                                       
CONECT    4   31   15   36   37                                       
CONECT    5   32    9    9   31                                       
CONECT    6   16   32   38   39                                       
CONECT    7   10    8   19   40                                       
CONECT    8    7   21   21   22                                       
CONECT    9    5    5                                                 
CONECT   10   11    7   41   42                                       
CONECT   11   20   12   10   43                                       
CONECT   12   11   44   45   46                                       
CONECT   13   26   47   48   49                                       
CONECT   14   23   24   24   25                                       
CONECT   15   29    4    3    3                                       
CONECT   16   19   18   18   17                                       
CONECT   16    6                                                      
CONECT   17   16   50                                                 
CONECT   18   16   16                                                 
CONECT   19    7   16   51                                            
CONECT   20   11   52   53   54                                       
CONECT   21    8    8                                                 
CONECT   22    8   23   55                                            
CONECT   23   26   22   14   56                                       
CONECT   24   14   14                                                 
CONECT   25   14   57                                                 
CONECT   26   28   13   27   23                                       
CONECT   27   26   58   59   60                                       
CONECT   28   26   61   62   63                                       
CONECT   29   30   30   15   64                                       
CONECT   30   29   29    1   65                                       
CONECT   31    5    4                                                 
CONECT   32    6    5   66                                            
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   17                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   25                                                      
CONECT   58   27                                                      
CONECT   59   27                                                      
CONECT   60   27                                                      
CONECT   61   28                                                      
CONECT   62   28                                                      
CONECT   63   28                                                      
CONECT   64   29                                                      
CONECT   65   30                                                      
CONECT   66   32                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
