COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       6.940  -2.184   1.094  1.00  0.00           O  
HETATM    2  C   UNL     1       6.085  -1.691   0.178  1.00  0.00           C  
HETATM    3  O   UNL     1       5.787  -2.356  -0.794  1.00  0.00           O  
HETATM    4  C   UNL     1       5.510  -0.341   0.354  1.00  0.00           C  
HETATM    5  C   UNL     1       4.623   0.173  -0.594  1.00  0.00           C  
HETATM    6  C   UNL     1       5.846   0.423   1.473  1.00  0.00           C  
HETATM    7  C   UNL     1       5.306   1.683   1.632  1.00  0.00           C  
HETATM    8  C   UNL     1       4.432   2.188   0.686  1.00  0.00           C  
HETATM    9  C   UNL     1       4.090   1.433  -0.423  1.00  0.00           C  
HETATM   10  C   UNL     1       3.133   1.990  -1.445  1.00  0.00           C  
HETATM   11  N   UNL     1       1.762   1.627  -1.079  1.00  0.00           N  
HETATM   12  C   UNL     1       0.733   2.489  -0.915  1.00  0.00           C  
HETATM   13  N   UNL     1       1.332   0.433  -0.864  1.00  0.00           N  
HETATM   14  N   UNL     1       0.082   0.452  -0.562  1.00  0.00           N  
HETATM   15  C   UNL     1      -0.349   1.726  -0.580  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.723   2.205  -0.295  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.735   1.291   0.039  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.485  -0.040   0.111  1.00  0.00           N  
HETATM   19  C   UNL     1      -2.016   3.564  -0.351  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.293   4.025  -0.081  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.301   3.143   0.253  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.031   1.779   0.322  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.069   0.801   0.686  1.00  0.00           C  
HETATM   24  O   UNL     1      -6.020   1.102   1.376  1.00  0.00           O  
HETATM   25  C   UNL     1      -4.880  -0.606   0.151  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.412  -0.943   0.197  1.00  0.00           C  
HETATM   27  N   UNL     1      -3.043  -2.250   0.327  1.00  0.00           N  
HETATM   28  C   UNL     1      -4.047  -3.326   0.308  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.598  -4.387  -0.704  1.00  0.00           C  
HETATM   30  O   UNL     1      -2.254  -4.777  -0.412  1.00  0.00           O  
HETATM   31  C   UNL     1      -1.299  -3.720  -0.530  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.629  -2.626   0.485  1.00  0.00           C  
HETATM   33  H   UNL     1       7.291  -3.071   0.936  1.00  0.00           H  
HETATM   34  H   UNL     1       4.356  -0.415  -1.459  1.00  0.00           H  
HETATM   35  H   UNL     1       6.528   0.030   2.213  1.00  0.00           H  
HETATM   36  H   UNL     1       5.565   2.275   2.497  1.00  0.00           H  
HETATM   37  H   UNL     1       4.011   3.174   0.815  1.00  0.00           H  
HETATM   38  H   UNL     1       3.225   3.075  -1.476  1.00  0.00           H  
HETATM   39  H   UNL     1       3.368   1.577  -2.426  1.00  0.00           H  
HETATM   40  H   UNL     1       0.761   3.563  -1.027  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.237   4.267  -0.608  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.502   5.083  -0.133  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.295   3.511   0.465  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.435  -1.311   0.769  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.236  -0.657  -0.878  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.125  -3.773   1.298  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.014  -2.920   0.010  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.253  -5.255  -0.635  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.647  -3.973  -1.711  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.300  -4.110  -0.335  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.338  -3.305  -1.536  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.996  -1.757   0.305  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.460  -3.001   1.494  1.00  0.00           H  
CONECT    1    2   33                                                 
CONECT    2    3    3    1    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    6    6    5                                       
CONECT    5    4    9    9   34                                       
CONECT    6    4    4    7   35                                       
CONECT    7    6    8    8   36                                       
CONECT    8    7    7    9   37                                       
CONECT    9    5    5    8   10                                       
CONECT   10    9   11   38   39                                       
CONECT   11   12   10   13                                            
CONECT   12   11   15   15   40                                       
CONECT   13   11   14   14                                            
CONECT   14   15   13   13                                            
CONECT   15   12   12   16   14                                       
CONECT   16   19   15   17   17                                       
CONECT   17   16   16   22   18                                       
CONECT   18   17   26   26                                            
CONECT   19   20   20   16   41                                       
CONECT   20   19   19   21   42                                       
CONECT   21   20   22   22   43                                       
CONECT   22   21   21   17   23                                       
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   26   44   45                                       
CONECT   26   18   18   25   27                                       
CONECT   27   26   28   32                                            
CONECT   28   27   29   46   47                                       
CONECT   29   28   30   48   49                                       
CONECT   30   29   31                                                 
CONECT   31   32   30   50   51                                       
CONECT   32   27   31   52   53                                       
CONECT   33    1                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   12                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
CONECT   46   28                                                      
CONECT   47   28                                                      
CONECT   48   29                                                      
CONECT   49   29                                                      
CONECT   50   31                                                      
CONECT   51   31                                                      
CONECT   52   32                                                      
CONECT   53   32                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
