COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.028  -0.545  -1.641  1.00  0.00           C  
HETATM    2  C   UNL     1      -8.276  -0.187  -2.115  1.00  0.00           C  
HETATM    3  C   UNL     1      -9.346  -0.096  -1.244  1.00  0.00           C  
HETATM    4  C   UNL     1      -9.167  -0.363   0.100  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.919  -0.722   0.574  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.849  -0.812  -0.297  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.490  -1.208   0.219  1.00  0.00           C  
HETATM    8  O   UNL     1      -4.753  -0.018   0.606  1.00  0.00           O  
HETATM    9  C   UNL     1      -3.510  -0.200   1.091  1.00  0.00           C  
HETATM   10  O   UNL     1      -3.054  -1.322   1.188  1.00  0.00           O  
HETATM   11  N   UNL     1      -2.773   0.863   1.469  1.00  0.00           N  
HETATM   12  C   UNL     1      -1.420   0.666   1.996  1.00  0.00           C  
HETATM   13  P   UNL     1      -0.208   0.854   0.648  1.00  0.00           P  
HETATM   14  O   UNL     1      -0.479  -0.153  -0.403  1.00  0.00           O  
HETATM   15  O   UNL     1      -0.329   2.331   0.020  1.00  0.00           O  
HETATM   16  N   UNL     1       1.345   0.627   1.254  1.00  0.00           N  
HETATM   17  C   UNL     1       2.341   0.658   0.175  1.00  0.00           C  
HETATM   18  C   UNL     1       3.449  -0.315   0.486  1.00  0.00           C  
HETATM   19  O   UNL     1       3.551  -0.782   1.600  1.00  0.00           O  
HETATM   20  C   UNL     1       2.920   2.069   0.056  1.00  0.00           C  
HETATM   21  C   UNL     1       3.849   2.139  -1.158  1.00  0.00           C  
HETATM   22  C   UNL     1       3.029   1.973  -2.439  1.00  0.00           C  
HETATM   23  C   UNL     1       4.561   3.493  -1.179  1.00  0.00           C  
HETATM   24  N   UNL     1       4.327  -0.666  -0.475  1.00  0.00           N  
HETATM   25  CA  UNL     1       5.338  -1.691  -0.205  1.00  0.00           C  
HETATM   26  C   UNL     1       6.534  -1.056   0.455  1.00  0.00           C  
HETATM   27  O   UNL     1       6.543   0.131   0.677  1.00  0.00           O  
HETATM   28  C   UNL     1       5.767  -2.343  -1.520  1.00  0.00           C  
HETATM   29  C   UNL     1       4.581  -3.094  -2.129  1.00  0.00           C  
HETATM   30  OXT UNL     1       7.591  -1.810   0.797  1.00  0.00           O  
HETATM   31  H   UNL     1      -6.193  -0.620  -2.322  1.00  0.00           H  
HETATM   32  H   UNL     1      -8.416   0.022  -3.165  1.00  0.00           H  
HETATM   33  H   UNL     1     -10.321   0.185  -1.614  1.00  0.00           H  
HETATM   34  H   UNL     1     -10.003  -0.291   0.781  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.780  -0.931   1.624  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.606  -1.861   1.084  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.944  -1.735  -0.564  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.137   1.759   1.391  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.221   1.407   2.770  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.339  -0.335   2.421  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.090   3.040   0.633  1.00  0.00           H  
HETATM   42  H   UNL     1       1.560   1.311   1.964  1.00  0.00           H  
HETATM   43  H   UNL     1       1.867   0.380  -0.766  1.00  0.00           H  
HETATM   44  H   UNL     1       2.108   2.786  -0.067  1.00  0.00           H  
HETATM   45  H   UNL     1       3.483   2.309   0.958  1.00  0.00           H  
HETATM   46  H   UNL     1       4.589   1.341  -1.095  1.00  0.00           H  
HETATM   47  H   UNL     1       3.699   1.948  -3.298  1.00  0.00           H  
HETATM   48  H   UNL     1       2.464   1.042  -2.391  1.00  0.00           H  
HETATM   49  H   UNL     1       2.340   2.812  -2.539  1.00  0.00           H  
HETATM   50  H   UNL     1       5.145   3.611  -0.266  1.00  0.00           H  
HETATM   51  H   UNL     1       5.223   3.543  -2.043  1.00  0.00           H  
HETATM   52  H   UNL     1       3.821   4.291  -1.242  1.00  0.00           H  
HETATM   53  H   UNL     1       4.290  -0.239  -1.345  1.00  0.00           H  
HETATM   54  HA  UNL     1       4.918  -2.450   0.456  1.00  0.00           H  
HETATM   55  H   UNL     1       6.104  -1.574  -2.214  1.00  0.00           H  
HETATM   56  H   UNL     1       6.581  -3.043  -1.331  1.00  0.00           H  
HETATM   57  H   UNL     1       3.767  -2.394  -2.319  1.00  0.00           H  
HETATM   58  H   UNL     1       4.887  -3.559  -3.066  1.00  0.00           H  
HETATM   59  H   UNL     1       4.243  -3.864  -1.435  1.00  0.00           H  
HETATM   60  HXT UNL     1       8.335  -1.358   1.218  1.00  0.00           H  
CONECT    1    2    6    6   31                                       
CONECT    2    3    3    1   32                                       
CONECT    3    2    2    4   33                                       
CONECT    4    3    5    5   34                                       
CONECT    5    6    4    4   35                                       
CONECT    6    1    1    7    5                                       
CONECT    7    6    8   36   37                                       
CONECT    8    7    9                                                 
CONECT    9    8   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   12   38                                            
CONECT   12   11   13   39   40                                       
CONECT   13   12   14   14   15                                       
CONECT   13   16                                                      
CONECT   14   13   13                                                 
CONECT   15   13   41                                                 
CONECT   16   13   17   42                                            
CONECT   17   16   18   20   43                                       
CONECT   18   17   24   19   19                                       
CONECT   19   18   18                                                 
CONECT   20   17   21   44   45                                       
CONECT   21   20   23   22   46                                       
CONECT   22   21   47   48   49                                       
CONECT   23   21   50   51   52                                       
CONECT   24   18   25   53                                            
CONECT   25   24   26   28   54                                       
CONECT   26   25   27   27   30                                       
CONECT   27   26   26                                                 
CONECT   28   25   29   55   56                                       
CONECT   29   28   57   58   59                                       
CONECT   30   26   60                                                 
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
CONECT   55   28                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
CONECT   58   29                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
