COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -8.392  -3.178  -0.268  1.00  0.00           O  
HETATM    2  C   UNL     1      -8.384  -1.836  -0.247  1.00  0.00           C  
HETATM    3  OXT UNL     1      -9.417  -1.227  -0.101  1.00  0.00           O  
HETATM    4  CA  UNL     1      -7.085  -1.087  -0.406  1.00  0.00           C  
HETATM    5  N   UNL     1      -7.364   0.293  -0.825  1.00  0.00           N  
HETATM    6  C   UNL     1      -6.337  -1.074   0.929  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.986  -0.435   0.741  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.841   0.931   0.910  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.605   1.522   0.739  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.503   0.741   0.396  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.655  -0.635   0.228  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.894  -1.216   0.407  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.173   1.370   0.211  1.00  0.00           C  
HETATM   14  N   UNL     1      -0.123   0.623  -0.116  1.00  0.00           N  
HETATM   15  C   UNL     1       1.069   1.188  -0.282  1.00  0.00           C  
HETATM   16  N   UNL     1       1.211   2.499  -0.120  1.00  0.00           N  
HETATM   17  C   UNL     1       0.162   3.247   0.206  1.00  0.00           C  
HETATM   18  N   UNL     1       0.310   4.609   0.373  1.00  0.00           N  
HETATM   19  N   UNL     1      -1.032   2.683   0.367  1.00  0.00           N  
HETATM   20  N   UNL     1       2.159   0.412  -0.621  1.00  0.00           N  
HETATM   21  C   UNL     1       3.472   1.034  -0.804  1.00  0.00           C  
HETATM   22  C   UNL     1       3.590   1.566  -2.234  1.00  0.00           C  
HETATM   23  C   UNL     1       4.551   0.012  -0.557  1.00  0.00           C  
HETATM   24  C   UNL     1       4.385  -1.289  -1.028  1.00  0.00           C  
HETATM   25  C   UNL     1       5.340  -2.237  -0.822  1.00  0.00           C  
HETATM   26  C   UNL     1       6.513  -1.902  -0.125  1.00  0.00           C  
HETATM   27  C   UNL     1       7.522  -2.853   0.106  1.00  0.00           C  
HETATM   28  C   UNL     1       8.645  -2.492   0.784  1.00  0.00           C  
HETATM   29  C   UNL     1       8.811  -1.191   1.255  1.00  0.00           C  
HETATM   30  C   UNL     1       7.856  -0.243   1.050  1.00  0.00           C  
HETATM   31  C   UNL     1       6.683  -0.578   0.353  1.00  0.00           C  
HETATM   32  C   UNL     1       5.677   0.374   0.117  1.00  0.00           C  
HETATM   33  H   UNL     1      -9.249  -3.613  -0.162  1.00  0.00           H  
HETATM   34  HA  UNL     1      -6.472  -1.580  -1.161  1.00  0.00           H  
HETATM   35  H1  UNL     1      -7.800   0.313  -1.735  1.00  0.00           H  
HETATM   36  H2  UNL     1      -7.931   0.771  -0.141  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.910  -0.505   1.661  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.209  -2.097   1.283  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.695   1.535   1.175  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.493   2.588   0.870  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.805  -1.245  -0.038  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.013  -2.282   0.280  1.00  0.00           H  
HETATM   43  H   UNL     1       1.180   5.020   0.252  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.456   5.154   0.612  1.00  0.00           H  
HETATM   45  H   UNL     1       2.055  -0.545  -0.738  1.00  0.00           H  
HETATM   46  H   UNL     1       3.585   1.858  -0.100  1.00  0.00           H  
HETATM   47  H   UNL     1       3.478   0.742  -2.938  1.00  0.00           H  
HETATM   48  H   UNL     1       2.810   2.305  -2.412  1.00  0.00           H  
HETATM   49  H   UNL     1       4.568   2.029  -2.370  1.00  0.00           H  
HETATM   50  H   UNL     1       3.484  -1.550  -1.563  1.00  0.00           H  
HETATM   51  H   UNL     1       5.196  -3.241  -1.192  1.00  0.00           H  
HETATM   52  H   UNL     1       7.406  -3.865  -0.253  1.00  0.00           H  
HETATM   53  H   UNL     1       9.418  -3.224   0.961  1.00  0.00           H  
HETATM   54  H   UNL     1       9.712  -0.930   1.791  1.00  0.00           H  
HETATM   55  H   UNL     1       7.999   0.761   1.421  1.00  0.00           H  
HETATM   56  H   UNL     1       5.795   1.387   0.472  1.00  0.00           H  
CONECT    1    2   33                                                 
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    6    5   34                                       
CONECT    5    4   35   36                                            
CONECT    6    4    7   37   38                                       
CONECT    7    6   12   12    8                                       
CONECT    8    7    9    9   39                                       
CONECT    9    8    8   10   40                                       
CONECT   10    9   11   11   13                                       
CONECT   11   10   10   12   41                                       
CONECT   12    7    7   11   42                                       
CONECT   13   10   19   19   14                                       
CONECT   14   13   15   15                                            
CONECT   15   14   14   16   20                                       
CONECT   16   15   17   17                                            
CONECT   17   16   16   18   19                                       
CONECT   18   17   43   44                                            
CONECT   19   13   13   17                                            
CONECT   20   15   21   45                                            
CONECT   21   20   23   22   46                                       
CONECT   22   21   47   48   49                                       
CONECT   23   21   24   24   32                                       
CONECT   24   23   23   25   50                                       
CONECT   25   24   26   26   51                                       
CONECT   26   25   25   27   31                                       
CONECT   27   26   28   28   52                                       
CONECT   28   27   27   29   53                                       
CONECT   29   28   30   30   54                                       
CONECT   30   29   29   31   55                                       
CONECT   31   26   30   32   32                                       
CONECT   32   23   31   31   56                                       
CONECT   33    1                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   24                                                      
CONECT   51   25                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
CONECT   56   32                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
