COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNK A   0       0.036   1.774   0.927  1.00  0.00           O  
HETATM    2  C   UNK A   0       0.413   1.801  -0.226  1.00  0.00           C  
HETATM    3  N   UNK A   0       0.651   2.982  -0.829  1.00  0.00           N  
HETATM    4  O   UNK A   0       0.459   4.192  -0.118  1.00  0.00           O  
HETATM    5  C   UNK A   0       0.623   0.513  -0.980  1.00  0.00           C  
HETATM    6  C   UNK A   0       0.410  -0.672  -0.036  1.00  0.00           C  
HETATM    7  C   UNK A   0      -0.961  -0.579   0.584  1.00  0.00           C  
HETATM    8  O   UNK A   0      -1.077  -0.499   1.788  1.00  0.00           O  
ATOM      9  N   ALA A   1      -2.057  -0.586  -0.200  1.00  0.00           N  
ATOM     10  CA  ALA A   1      -3.389  -0.496   0.402  1.00  0.00           C  
ATOM     11  CB  ALA A   1      -3.745   0.973   0.637  1.00  0.00           C  
ATOM     12  C   ALA A   1      -4.403  -1.117  -0.524  1.00  0.00           C  
ATOM     13  O   ALA A   1      -4.048  -1.587  -1.580  1.00  0.00           O  
ATOM     14  OXT ALA A   1      -5.699  -1.149  -0.177  1.00  0.00           O  
HETATM   15  C   UNK A   0       1.471  -0.644   1.066  1.00  0.00           C  
HETATM   16  C   UNK A   0       2.833  -0.858   0.457  1.00  0.00           C  
HETATM   17  C   UNK A   0       3.584   0.227   0.047  1.00  0.00           C  
HETATM   18  C   UNK A   0       4.834   0.031  -0.512  1.00  0.00           C  
HETATM   19  C   UNK A   0       5.331  -1.250  -0.660  1.00  0.00           C  
HETATM   20  C   UNK A   0       4.579  -2.335  -0.249  1.00  0.00           C  
HETATM   21  C   UNK A   0       3.332  -2.139   0.315  1.00  0.00           C  
HETATM   22  H   UNK A   0       0.953   3.004  -1.751  1.00  0.00           H  
HETATM   23  H   UNK A   0       0.654   4.986  -0.634  1.00  0.00           H  
HETATM   24  H   UNK A   0      -0.088   0.455  -1.804  1.00  0.00           H  
HETATM   25  H   UNK A   0       1.639   0.485  -1.375  1.00  0.00           H  
HETATM   26  H   UNK A   0       0.493  -1.603  -0.597  1.00  0.00           H  
ATOM     27  H   ALA A   1      -1.964  -0.650  -1.164  1.00  0.00           H  
ATOM     28  HA  ALA A   1      -3.394  -1.027   1.354  1.00  0.00           H  
ATOM     29  HB1 ALA A   1      -4.736   1.040   1.085  1.00  0.00           H  
ATOM     30  HB2 ALA A   1      -3.012   1.422   1.307  1.00  0.00           H  
ATOM     31  HB3 ALA A   1      -3.741   1.504  -0.315  1.00  0.00           H  
ATOM     32  HXT ALA A   1      -6.312  -1.557  -0.804  1.00  0.00           H  
HETATM   33  H   UNK A   0       1.446   0.322   1.570  1.00  0.00           H  
HETATM   34  H   UNK A   0       1.267  -1.435   1.787  1.00  0.00           H  
HETATM   35  H   UNK A   0       3.196   1.228   0.162  1.00  0.00           H  
HETATM   36  H   UNK A   0       5.421   0.879  -0.833  1.00  0.00           H  
HETATM   37  H   UNK A   0       6.307  -1.404  -1.096  1.00  0.00           H  
HETATM   38  H   UNK A   0       4.968  -3.336  -0.365  1.00  0.00           H  
HETATM   39  H   UNK A   0       2.745  -2.986   0.635  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    5    3    1    1                                       
CONECT    3    2    4   22                                            
CONECT    4    3   23                                                 
CONECT    5    6    2   24   25                                       
CONECT    6    7    5   15   26                                       
CONECT    7    8    8    9    6                                       
CONECT    8    7    7                                                 
CONECT    9   10    7   27                                            
CONECT   10   12   11    9   28                                       
CONECT   11   10   29   30   31                                       
CONECT   12   13   13   10   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   32                                                 
CONECT   15    6   16   33   34                                       
CONECT   16   21   15   17   17                                       
CONECT   17   16   16   18   35                                       
CONECT   18   19   19   17   36                                       
CONECT   19   20   18   18   37                                       
CONECT   20   21   21   19   38                                       
CONECT   21   20   20   16   39                                       
CONECT   22    3                                                      
CONECT   23    4                                                      
CONECT   24    5                                                      
CONECT   25    5                                                      
CONECT   26    6                                                      
CONECT   27    9                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   11                                                      
CONECT   31   11                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   15                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   21                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
