COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.853  -0.257  -0.652  1.00  0.00           C  
HETATM    2  C   UNL     1       6.855   1.499   0.635  1.00  0.00           C  
HETATM    3  C   UNL     1       5.608   0.641   0.862  1.00  0.00           C  
HETATM    4  C   UNL     1       6.615  -1.133  -0.438  1.00  0.00           C  
HETATM    5  C   UNL     1       1.718  -1.002  -0.051  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.641  -0.002   0.056  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.880   0.233  -0.101  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.154  -0.313   0.017  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.739   2.362  -0.365  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.262   0.534  -0.063  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.038   1.899  -0.258  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.693  -0.650  -0.019  1.00  0.00           C  
HETATM   13  C   UNL     1       2.989  -0.165  -0.209  1.00  0.00           C  
HETATM   14  C   UNL     1       4.214  -1.077  -0.125  1.00  0.00           C  
HETATM   15  N   UNL     1       5.434  -0.273  -0.276  1.00  0.00           N  
HETATM   16  N   UNL     1      -7.742  -0.138   0.136  1.00  0.00           N  
HETATM   17  N   UNL     1      -7.276  -1.328   0.292  1.00  0.00           N  
HETATM   18  N   UNL     1      -6.762   0.688  -0.006  1.00  0.00           N  
HETATM   19  N   UNL     1      -5.988  -1.283   0.243  1.00  0.00           N  
HETATM   20  N   UNL     1      -1.717   1.537  -0.292  1.00  0.00           N  
HETATM   21  N   UNL     1       0.545  -0.129  -0.132  1.00  0.00           N  
HETATM   22  O   UNL     1       7.987   0.646   0.449  1.00  0.00           O  
HETATM   23  O   UNL     1      -0.835  -1.845   0.150  1.00  0.00           O  
HETATM   24  H   UNL     1       8.739  -0.889  -0.715  1.00  0.00           H  
HETATM   25  H   UNL     1       7.743   0.310  -1.576  1.00  0.00           H  
HETATM   26  H   UNL     1       6.715   2.117  -0.252  1.00  0.00           H  
HETATM   27  H   UNL     1       7.020   2.139   1.502  1.00  0.00           H  
HETATM   28  H   UNL     1       5.726   0.063   1.779  1.00  0.00           H  
HETATM   29  H   UNL     1       4.733   1.286   0.949  1.00  0.00           H  
HETATM   30  H   UNL     1       6.476  -1.784  -1.301  1.00  0.00           H  
HETATM   31  H   UNL     1       6.750  -1.740   0.457  1.00  0.00           H  
HETATM   32  H   UNL     1       1.672  -1.747  -0.846  1.00  0.00           H  
HETATM   33  H   UNL     1       1.731  -1.504   0.916  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.284  -1.375   0.167  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.561   3.416  -0.516  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.869   2.586  -0.320  1.00  0.00           H  
HETATM   37  H   UNL     1       2.976   0.337  -1.177  1.00  0.00           H  
HETATM   38  H   UNL     1       3.034   0.580   0.586  1.00  0.00           H  
HETATM   39  H   UNL     1       4.228  -1.579   0.843  1.00  0.00           H  
HETATM   40  H   UNL     1       4.169  -1.821  -0.919  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.682   0.101   0.132  1.00  0.00           H  
HETATM   42  H   UNL     1       0.658   0.825  -0.268  1.00  0.00           H  
CONECT    1    4   22   24   25                                       
CONECT    2    3   22   26   27                                       
CONECT    3   15    2   28   29                                       
CONECT    4   15    1   30   31                                       
CONECT    5   21   13   32   33                                       
CONECT    6   10   18   18   19                                       
CONECT    7   20   20    8   12                                       
CONECT    8   10   10    7   34                                       
CONECT    9   11   11   20   35                                       
CONECT   10   11    6    8    8                                       
CONECT   11    9    9   10   36                                       
CONECT   12    7   23   23   21                                       
CONECT   13    5   14   37   38                                       
CONECT   14   13   15   39   40                                       
CONECT   15   14    4    3                                            
CONECT   16   18   17   41                                            
CONECT   17   16   19   19                                            
CONECT   18    6    6   16                                            
CONECT   19    6   17   17                                            
CONECT   20    9    7    7                                            
CONECT   21   12    5   42                                            
CONECT   22    1    2                                                 
CONECT   23   12   12                                                 
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    8                                                      
CONECT   35    9                                                      
CONECT   36   11                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   16                                                      
CONECT   42   21                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
