COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.841  -2.236   8.523  1.00  0.00           C  
HETATM    2  C   UNL     1       1.242  -1.676   7.369  1.00  0.00           C  
HETATM    3  C   UNL     1       2.105  -1.928   6.324  1.00  0.00           C  
HETATM    4  O   UNL     1       3.197  -2.610   6.770  1.00  0.00           O  
HETATM    5  C   UNL     1       3.028  -2.792   8.106  1.00  0.00           C  
HETATM    6  C   UNL     1       4.085  -3.500   8.769  1.00  0.00           C  
HETATM    7  C   UNL     1       1.945  -1.563   4.967  1.00  0.00           C  
HETATM    8  C   UNL     1       4.015  -3.744  10.144  1.00  0.00           C  
HETATM    9  C   UNL     1       5.043  -4.431  10.790  1.00  0.00           C  
HETATM   10  C   UNL     1       6.146  -4.878  10.063  1.00  0.00           C  
HETATM   11  C   UNL     1       6.222  -4.638   8.691  1.00  0.00           C  
HETATM   12  C   UNL     1       5.194  -3.951   8.046  1.00  0.00           C  
HETATM   13  N   UNL     1       2.863  -1.863   4.000  1.00  0.00           N  
HETATM   14  C   UNL     1       2.395  -1.368   2.810  1.00  0.00           C  
HETATM   15  C   UNL     1       1.178  -0.777   3.136  1.00  0.00           C  
HETATM   16  N   UNL     1       0.915  -0.908   4.480  1.00  0.00           N  
HETATM   17  C   UNL     1       0.423  -0.162   2.123  1.00  0.00           C  
HETATM   18  C   UNL     1       0.926  -0.168   0.816  1.00  0.00           C  
HETATM   19  C   UNL     1       2.151  -0.770   0.520  1.00  0.00           C  
HETATM   20  C   UNL     1       2.916  -1.387   1.516  1.00  0.00           C  
HETATM   21  C   UNL     1       0.159   0.461  -0.248  1.00  0.00           C  
HETATM   22  C   UNL     1       7.218  -5.595  10.736  1.00  0.00           C  
HETATM   23  N   UNL     1       8.240  -5.999  10.010  1.00  0.00           N  
HETATM   24  N   UNL     1       7.239  -5.886  12.095  1.00  0.00           N  
HETATM   25  N   UNL     1      -0.991   1.018   0.069  1.00  0.00           N  
HETATM   26  N   UNL     1       0.557   0.514  -1.579  1.00  0.00           N  
HETATM   27  H   UNL     1       1.451  -2.232   9.531  1.00  0.00           H  
HETATM   28  H   UNL     1       0.297  -1.154   7.312  1.00  0.00           H  
HETATM   29  H   UNL     1       3.161  -3.402  10.724  1.00  0.00           H  
HETATM   30  H   UNL     1       4.974  -4.612  11.860  1.00  0.00           H  
HETATM   31  H   UNL     1       7.078  -4.981   8.116  1.00  0.00           H  
HETATM   32  H   UNL     1       5.269  -3.769   6.977  1.00  0.00           H  
HETATM   33  H   UNL     1       3.734  -2.361   4.133  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.531   0.304   2.354  1.00  0.00           H  
HETATM   35  H   UNL     1       2.528  -0.767  -0.501  1.00  0.00           H  
HETATM   36  H   UNL     1       3.867  -1.856   1.290  1.00  0.00           H  
HETATM   37  H   UNL     1       8.099  -5.722   9.032  1.00  0.00           H  
HETATM   38  H   UNL     1       8.009  -6.393  12.518  1.00  0.00           H  
HETATM   39  H   UNL     1       6.496  -5.596  12.720  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.161   0.908   1.074  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.016   0.961  -2.286  1.00  0.00           H  
HETATM   42  H   UNL     1       1.435   0.120  -1.895  1.00  0.00           H  
CONECT    1    5    5    2   27                                       
CONECT    2    1    3    3   28                                       
CONECT    3    2    2    4    7                                       
CONECT    4    3    5                                                 
CONECT    5    1    1    4    6                                       
CONECT    6    5    8    8   12                                       
CONECT    7    3   16   16   13                                       
CONECT    8    6    6    9   29                                       
CONECT    9    8   10   10   30                                       
CONECT   10    9    9   22   11                                       
CONECT   11   10   12   12   31                                       
CONECT   12    6   11   11   32                                       
CONECT   13    7   14   33                                            
CONECT   14   13   15   15   20                                       
CONECT   15   14   14   16   17                                       
CONECT   16    7    7   15                                            
CONECT   17   15   18   18   34                                       
CONECT   18   17   17   19   21                                       
CONECT   19   18   20   20   35                                       
CONECT   20   14   19   19   36                                       
CONECT   21   18   26   25   25                                       
CONECT   22   10   24   23   23                                       
CONECT   23   22   22   37                                            
CONECT   24   22   38   39                                            
CONECT   25   21   21   40                                            
CONECT   26   21   41   42                                            
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    8                                                      
CONECT   30    9                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   17                                                      
CONECT   35   19                                                      
CONECT   36   20                                                      
CONECT   37   23                                                      
CONECT   38   24                                                      
CONECT   39   24                                                      
CONECT   40   25                                                      
CONECT   41   26                                                      
CONECT   42   26                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
