COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.200   5.411   0.452  1.00  0.00           C  
HETATM    2  C   UNL     1       4.247   4.078  -0.299  1.00  0.00           C  
HETATM    3  C   UNL     1       3.471   3.021   0.490  1.00  0.00           C  
HETATM    4  C   UNL     1       3.518   1.689  -0.260  1.00  0.00           C  
HETATM    5  C   UNL     1       2.742   0.632   0.529  1.00  0.00           C  
HETATM    6  C   UNL     1       2.788  -0.701  -0.222  1.00  0.00           C  
HETATM    7  O   UNL     1       4.126  -1.245  -0.209  1.00  0.00           O  
HETATM    8  C   UNL     1       4.007  -2.656  -0.453  1.00  0.00           C  
HETATM    9  O   UNL     1       5.018  -3.361   0.270  1.00  0.00           O  
HETATM   10  C   UNL     1       2.611  -3.090   0.035  1.00  0.00           C  
HETATM   11  C   UNL     1       1.950  -1.774   0.519  1.00  0.00           C  
HETATM   12  N   UNL     1       0.543  -1.716   0.117  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.536  -1.595   0.951  1.00  0.00           C  
HETATM   14  C   UNL     1       0.067  -1.778  -1.146  1.00  0.00           C  
HETATM   15  N   UNL     1      -1.235  -1.695  -1.107  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.633  -1.578   0.169  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.057  -1.457   0.644  1.00  0.00           C  
HETATM   18  CA  UNL     1      -3.732  -0.280  -0.062  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.189  -0.233   0.320  1.00  0.00           C  
HETATM   20  O   UNL     1      -5.989  -1.277   0.047  1.00  0.00           O  
HETATM   21  OXT UNL     1      -5.638   0.743   0.872  1.00  0.00           O  
HETATM   22  N   UNL     1      -3.082   0.970   0.340  1.00  0.00           N  
HETATM   23  C   UNL     1      -3.127   2.045  -0.471  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.458   3.330  -0.057  1.00  0.00           C  
HETATM   25  O   UNL     1      -3.706   1.978  -1.535  1.00  0.00           O  
HETATM   26  H   UNL     1       4.753   6.164  -0.110  1.00  0.00           H  
HETATM   27  H   UNL     1       3.164   5.729   0.563  1.00  0.00           H  
HETATM   28  H   UNL     1       4.651   5.289   1.437  1.00  0.00           H  
HETATM   29  H   UNL     1       3.796   4.200  -1.284  1.00  0.00           H  
HETATM   30  H   UNL     1       5.284   3.760  -0.410  1.00  0.00           H  
HETATM   31  H   UNL     1       3.922   2.900   1.475  1.00  0.00           H  
HETATM   32  H   UNL     1       2.434   3.340   0.601  1.00  0.00           H  
HETATM   33  H   UNL     1       3.067   1.810  -1.245  1.00  0.00           H  
HETATM   34  H   UNL     1       4.554   1.371  -0.371  1.00  0.00           H  
HETATM   35  H   UNL     1       3.192   0.510   1.514  1.00  0.00           H  
HETATM   36  H   UNL     1       1.705   0.950   0.640  1.00  0.00           H  
HETATM   37  H   UNL     1       2.434  -0.576  -1.245  1.00  0.00           H  
HETATM   38  H   UNL     1       4.105  -2.858  -1.519  1.00  0.00           H  
HETATM   39  H   UNL     1       5.870  -3.048  -0.064  1.00  0.00           H  
HETATM   40  H   UNL     1       2.037  -3.522  -0.785  1.00  0.00           H  
HETATM   41  H   UNL     1       2.697  -3.800   0.857  1.00  0.00           H  
HETATM   42  H   UNL     1       2.049  -1.663   1.599  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.512  -1.521   2.028  1.00  0.00           H  
HETATM   44  H   UNL     1       0.665  -1.879  -2.039  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.597  -2.376   0.415  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.068  -1.289   1.721  1.00  0.00           H  
HETATM   47  HA  UNL     1      -3.644  -0.404  -1.141  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.924  -1.247   0.292  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.618   1.023   1.191  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.427   3.333  -0.412  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.994   4.174  -0.490  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.468   3.411   1.030  1.00  0.00           H  
CONECT    1    2   26   27   28                                       
CONECT    2    1    3   29   30                                       
CONECT    3    2    4   31   32                                       
CONECT    4    3    5   33   34                                       
CONECT    5    4    6   35   36                                       
CONECT    6    5    7   11   37                                       
CONECT    7    6    8                                                 
CONECT    8    7    9   10   38                                       
CONECT    9    8   39                                                 
CONECT   10    8   11   40   41                                       
CONECT   11    6   10   12   42                                       
CONECT   12   11   13   14                                            
CONECT   13   12   16   16   43                                       
CONECT   14   12   15   15   44                                       
CONECT   15   14   14   16                                            
CONECT   16   13   13   15   17                                       
CONECT   17   16   18   45   46                                       
CONECT   18   17   19   22   47                                       
CONECT   19   18   20   21   21                                       
CONECT   20   19   48                                                 
CONECT   21   19   19                                                 
CONECT   22   18   23   49                                            
CONECT   23   22   24   25   25                                       
CONECT   24   23   50   51   52                                       
CONECT   25   23   23                                                 
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   13                                                      
CONECT   44   14                                                      
CONECT   45   17                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   20                                                      
CONECT   49   22                                                      
CONECT   50   24                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
