COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.530   0.595   8.880  1.00  0.00           C  
HETATM    2  C   UNL     1       0.363  -0.141   7.881  1.00  0.00           C  
HETATM    3  C   UNL     1       1.797   0.379   7.999  1.00  0.00           C  
HETATM    4  C   UNL     1       0.338  -1.640   8.183  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.001  -0.328   4.228  1.00  0.00           N  
HETATM    6  C   UNL     1      -1.175   0.522   3.988  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.821   1.553   2.909  1.00  0.00           C  
HETATM    8  C   UNL     1       0.612  -1.026   3.090  1.00  0.00           C  
HETATM    9  C   UNL     1       0.963   0.000   2.012  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.717   0.985   0.530  1.00  0.00           C  
HETATM   11  O   UNL     1      -1.629   1.764   0.327  1.00  0.00           O  
HETATM   12  N   UNL     1      -0.210   0.851   1.772  1.00  0.00           N  
HETATM   13  C   UNL     1       0.221   0.074  -2.884  1.00  0.00           C  
HETATM   14  C   UNL     1       1.288   1.134  -2.784  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.215   0.255  -0.485  1.00  0.00           N  
HETATM   16  CA  UNL     1      -0.839   0.315  -1.809  1.00  0.00           C  
HETATM   17  O   UNL     1       2.434   0.818  -2.570  1.00  0.00           O  
HETATM   18  C   UNL     1      -0.431   0.137  -4.267  1.00  0.00           C  
HETATM   19  C   UNL     1       0.629  -0.103  -5.343  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.022  -0.040  -6.725  1.00  0.00           C  
HETATM   21  N   UNL     1       0.993  -0.271  -7.755  1.00  0.00           N  
HETATM   22  C   UNL     1       0.639  -0.261  -9.084  1.00  0.00           C  
HETATM   23  N   UNL     1       1.593  -0.478 -10.051  1.00  0.00           N  
HETATM   24  N   UNL     1      -0.599  -0.046  -9.427  1.00  0.00           N  
HETATM   25  C   UNL     1      -1.906  -0.743  -1.909  1.00  0.00           C  
HETATM   26  O   UNL     1      -1.785  -1.886  -1.215  1.00  0.00           O  
HETATM   27  OXT UNL     1      -2.871  -0.564  -2.614  1.00  0.00           O  
HETATM   28  C   UNL     1       0.505  -0.463   5.470  1.00  0.00           C  
HETATM   29  O   UNL     1       1.536  -1.084   5.641  1.00  0.00           O  
HETATM   30  N   UNL     1      -0.129   0.091   6.521  1.00  0.00           N  
HETATM   31  H   UNL     1      -0.163   0.422   9.892  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.512   1.663   8.665  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.552   0.224   8.796  1.00  0.00           H  
HETATM   34  H   UNL     1       1.815   1.447   7.784  1.00  0.00           H  
HETATM   35  H   UNL     1       2.164   0.205   9.011  1.00  0.00           H  
HETATM   36  H   UNL     1       2.434  -0.145   7.287  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.683  -2.011   8.098  1.00  0.00           H  
HETATM   38  H   UNL     1       0.975  -2.165   7.470  1.00  0.00           H  
HETATM   39  H   UNL     1       0.705  -1.813   9.194  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.009  -0.091   3.647  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.449   1.036   4.909  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.725   2.064   2.581  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.114   2.277   3.314  1.00  0.00           H  
HETATM   44  H   UNL     1       1.517  -1.537   3.417  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.094  -1.752   2.687  1.00  0.00           H  
HETATM   46  H   UNL     1       1.237  -0.514   1.091  1.00  0.00           H  
HETATM   47  H   UNL     1       1.797   0.614   2.353  1.00  0.00           H  
HETATM   48  H   UNL     1       0.669  -0.907  -2.739  1.00  0.00           H  
HETATM   49  H   UNL     1       1.028   2.175  -2.903  1.00  0.00           H  
HETATM   50  H   UNL     1       0.559  -0.308  -0.339  1.00  0.00           H  
HETATM   51  HA  UNL     1      -1.288   1.298  -1.954  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.203  -0.628  -4.340  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.879   1.120  -4.413  1.00  0.00           H  
HETATM   54  H   UNL     1       1.401   0.662  -5.270  1.00  0.00           H  
HETATM   55  H   UNL     1       1.078  -1.086  -5.197  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.794  -0.806  -6.798  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.471   0.942  -6.871  1.00  0.00           H  
HETATM   58  H   UNL     1       1.915  -0.431  -7.500  1.00  0.00           H  
HETATM   59  H   UNL     1       1.343  -0.471 -10.988  1.00  0.00           H  
HETATM   60  H   UNL     1       2.515  -0.638  -9.795  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.848  -0.040 -10.364  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.470  -2.565  -1.280  1.00  0.00           H  
HETATM   63  H   UNL     1      -0.913   0.644   6.377  1.00  0.00           H  
CONECT    1    2   31   32   33                                       
CONECT    2    1    3    4   30                                       
CONECT    3    2   34   35   36                                       
CONECT    4    2   37   38   39                                       
CONECT    5    6    8   28                                            
CONECT    6    5    7   40   41                                       
CONECT    7    6   12   42   43                                       
CONECT    8    5    9   44   45                                       
CONECT    9    8   12   46   47                                       
CONECT   10   11   11   12   15                                       
CONECT   11   10   10                                                 
CONECT   12    7    9   10                                            
CONECT   13   14   16   18   48                                       
CONECT   14   13   17   17   49                                       
CONECT   15   10   16   50                                            
CONECT   16   13   15   25   51                                       
CONECT   17   14   14                                                 
CONECT   18   13   19   52   53                                       
CONECT   19   18   20   54   55                                       
CONECT   20   19   21   56   57                                       
CONECT   21   20   22   58                                            
CONECT   22   21   23   24   24                                       
CONECT   23   22   59   60                                            
CONECT   24   22   22   61                                            
CONECT   25   16   26   27   27                                       
CONECT   26   25   62                                                 
CONECT   27   25   25                                                 
CONECT   28    5   29   29   30                                       
CONECT   29   28   28                                                 
CONECT   30    2   28   63                                            
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    3                                                      
CONECT   37    4                                                      
CONECT   38    4                                                      
CONECT   39    4                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48   13                                                      
CONECT   49   14                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   19                                                      
CONECT   55   19                                                      
CONECT   56   20                                                      
CONECT   57   20                                                      
CONECT   58   21                                                      
CONECT   59   23                                                      
CONECT   60   23                                                      
CONECT   61   24                                                      
CONECT   62   26                                                      
CONECT   63   30                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
