COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.480   0.334   0.472  1.00  0.00           C  
HETATM    2  C   UNL     1       4.086  -0.283   0.655  1.00  0.00           C  
HETATM    3  C   UNL     1       3.048   0.724   0.147  1.00  0.00           C  
HETATM    4  C   UNL     1       0.662   0.941   0.217  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.615   0.157   0.055  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.923   0.117   0.068  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.923  -1.266  -0.239  1.00  0.00           C  
HETATM    8  O   UNL     1      -7.779   0.100   0.107  1.00  0.00           O  
HETATM    9  C   UNL     1      -6.624   0.779   0.247  1.00  0.00           C  
HETATM   10  O   UNL     1      -6.645   1.964   0.510  1.00  0.00           O  
HETATM   11  C   UNL     1      -5.332   0.081   0.081  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.149   0.784   0.227  1.00  0.00           C  
HETATM   13  N   UNL     1      -1.764   0.770   0.202  1.00  0.00           N  
HETATM   14  C   UNL     1      -5.316  -1.292  -0.225  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.141  -1.954  -0.381  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.691  -1.926  -0.408  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.544  -1.201  -0.252  1.00  0.00           C  
HETATM   18  O   UNL     1       1.781   0.075   0.015  1.00  0.00           O  
HETATM   19  O   UNL     1       3.992  -1.494  -0.098  1.00  0.00           O  
HETATM   20  C   UNL     1       3.480   1.257  -1.191  1.00  0.00           C  
HETATM   21  C   UNL     1       4.708   1.151  -1.627  1.00  0.00           C  
HETATM   22  O   UNL     1       5.694   0.549  -0.926  1.00  0.00           O  
HETATM   23  C   UNL     1       6.543  -0.621   1.016  1.00  0.00           C  
HETATM   24  O   UNL     1       7.829  -0.004   0.925  1.00  0.00           O  
HETATM   25  H   UNL     1       5.533   1.285   1.003  1.00  0.00           H  
HETATM   26  H   UNL     1       3.911  -0.491   1.710  1.00  0.00           H  
HETATM   27  H   UNL     1       2.963   1.547   0.856  1.00  0.00           H  
HETATM   28  H   UNL     1       0.688   1.747  -0.516  1.00  0.00           H  
HETATM   29  H   UNL     1       0.705   1.362   1.222  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.599   0.599   0.225  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.168   1.839   0.461  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.248  -1.825  -0.336  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.142  -3.008  -0.617  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.653  -2.980  -0.642  1.00  0.00           H  
HETATM   35  H   UNL     1       0.418  -1.679  -0.367  1.00  0.00           H  
HETATM   36  H   UNL     1       3.129  -1.926  -0.043  1.00  0.00           H  
HETATM   37  H   UNL     1       2.748   1.746  -1.817  1.00  0.00           H  
HETATM   38  H   UNL     1       4.946   1.564  -2.595  1.00  0.00           H  
HETATM   39  H   UNL     1       6.325  -0.852   2.059  1.00  0.00           H  
HETATM   40  H   UNL     1       6.539  -1.541   0.432  1.00  0.00           H  
HETATM   41  H   UNL     1       8.554  -0.554   1.253  1.00  0.00           H  
CONECT    1    2   23   22   25                                       
CONECT    2   19    3    1   26                                       
CONECT    3   18    2   20   27                                       
CONECT    4    5   18   28   29                                       
CONECT    5   17   17   13    4                                       
CONECT    6    7   12   13   13                                       
CONECT    7   15   16   16    6                                       
CONECT    8    9   30                                                 
CONECT    9   11   10   10    8                                       
CONECT   10    9    9                                                 
CONECT   11   14    9   12   12                                       
CONECT   12   11   11    6   31                                       
CONECT   13    6    6    5                                            
CONECT   14   15   15   11   32                                       
CONECT   15   14   14    7   33                                       
CONECT   16    7    7   17   34                                       
CONECT   17   16    5    5   35                                       
CONECT   18    4    3                                                 
CONECT   19    2   36                                                 
CONECT   20    3   21   21   37                                       
CONECT   21   22   20   20   38                                       
CONECT   22    1   21                                                 
CONECT   23   24    1   39   40                                       
CONECT   24   23   41                                                 
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    8                                                      
CONECT   31   12                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   16                                                      
CONECT   35   17                                                      
CONECT   36   19                                                      
CONECT   37   20                                                      
CONECT   38   21                                                      
CONECT   39   23                                                      
CONECT   40   23                                                      
CONECT   41   24                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
