COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.538  -0.665  -0.010  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.493   0.212  -0.001  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.999  -1.969  -0.017  1.00  0.00           C  
HETATM    4  O   UNL     1       3.070   2.775   0.036  1.00  0.00           O  
HETATM    5  C   UNL     1       1.522   1.027   0.007  1.00  0.00           C  
HETATM    6  C   UNL     1       1.318  -0.355  -0.008  1.00  0.00           C  
HETATM    7  C   UNL     1       0.425   1.892   0.016  1.00  0.00           C  
HETATM    8  C   UNL     1       0.037  -0.860  -0.012  1.00  0.00           C  
HETATM    9  C   UNL     1       2.894   1.572   0.018  1.00  0.00           C  
HETATM   10  C   UNL     1       5.313   1.278   0.021  1.00  0.00           C  
HETATM   11  C   UNL     1       6.305   0.143   0.007  1.00  0.00           C  
HETATM   12  C   UNL     1       6.836  -0.285  -1.195  1.00  0.00           C  
HETATM   13  C   UNL     1       7.748  -1.329  -1.197  1.00  0.00           C  
HETATM   14  C   UNL     1       8.092  -1.907   0.016  1.00  0.00           C  
HETATM   15  C   UNL     1       7.520  -1.425   1.178  1.00  0.00           C  
HETATM   16  N   UNL     1      -2.352  -0.512  -0.008  1.00  0.00           N  
HETATM   17  N   UNL     1      -2.696  -1.870  -0.019  1.00  0.00           N  
HETATM   18  C   UNL     1      -7.740   1.307   0.011  1.00  0.00           C  
HETATM   19  N   UNL     1      -8.637   0.338   0.001  1.00  0.00           N  
HETATM   20  C   UNL     1      -8.290  -0.935  -0.013  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.962  -1.307  -0.016  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.979  -0.313  -0.006  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.391   1.023   0.003  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.053   0.004  -0.003  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.854   1.380   0.011  1.00  0.00           C  
HETATM   26  N   UNL     1       3.951   0.737   0.009  1.00  0.00           N  
HETATM   27  N   UNL     1       6.659  -0.426   1.142  1.00  0.00           N  
HETATM   28  H   UNL     1      -3.564   1.289   0.010  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.565  -2.888  -0.021  1.00  0.00           H  
HETATM   30  H   UNL     1       2.164  -1.026  -0.015  1.00  0.00           H  
HETATM   31  H   UNL     1       0.579   2.961   0.028  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.122  -1.928  -0.023  1.00  0.00           H  
HETATM   33  H   UNL     1       5.458   1.877   0.919  1.00  0.00           H  
HETATM   34  H   UNL     1       5.463   1.902  -0.860  1.00  0.00           H  
HETATM   35  H   UNL     1       6.544   0.188  -2.121  1.00  0.00           H  
HETATM   36  H   UNL     1       8.179  -1.685  -2.121  1.00  0.00           H  
HETATM   37  H   UNL     1       8.799  -2.722   0.052  1.00  0.00           H  
HETATM   38  H   UNL     1       7.783  -1.869   2.127  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.068   2.336   0.022  1.00  0.00           H  
HETATM   40  H   UNL     1      -9.056  -1.696  -0.020  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.685  -2.351  -0.027  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.663   1.821   0.007  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.702   2.048   0.019  1.00  0.00           H  
HETATM   44  H   UNL     1       3.811  -0.223  -0.005  1.00  0.00           H  
CONECT    1    3    2    2   22                                       
CONECT    2   16    1    1   28                                       
CONECT    3   17   17    1   29                                       
CONECT    4    9    9                                                 
CONECT    5    9    6    6    7                                       
CONECT    6    5    5    8   30                                       
CONECT    7    5   25   25   31                                       
CONECT    8    6   24   24   32                                       
CONECT    9   26    4    4    5                                       
CONECT   10   11   26   33   34                                       
CONECT   11   27   27   12   10                                       
CONECT   12   13   13   11   35                                       
CONECT   13   14   12   12   36                                       
CONECT   14   15   15   13   37                                       
CONECT   15   14   14   27   38                                       
CONECT   16   24   17    2                                            
CONECT   17   16    3    3                                            
CONECT   18   23   23   19   39                                       
CONECT   19   20   20   18                                            
CONECT   20   21   19   19   40                                       
CONECT   21   22   22   20   41                                       
CONECT   22    1   21   21   23                                       
CONECT   23   22   18   18   42                                       
CONECT   24    8    8   25   16                                       
CONECT   25    7    7   24   43                                       
CONECT   26   10    9   44                                            
CONECT   27   15   11   11                                            
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    6                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   18                                                      
CONECT   40   20                                                      
CONECT   41   21                                                      
CONECT   42   23                                                      
CONECT   43   25                                                      
CONECT   44   26                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
