COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.290  -0.542  -0.035  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.127  -1.654  -0.203  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.523  -3.930  -0.747  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.686   2.043   1.008  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.262   2.955  -0.077  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.200   2.222   0.883  1.00  0.00           C  
HETATM    7  C   UNL     1       0.404   0.290  -0.369  1.00  0.00           C  
HETATM    8  C   UNL     1       1.078   1.639  -0.114  1.00  0.00           C  
HETATM    9  C   UNL     1       5.800   0.045   0.142  1.00  0.00           C  
HETATM   10  C   UNL     1       7.056   0.325  -0.403  1.00  0.00           C  
HETATM   11  C   UNL     1       8.136  -0.437   0.010  1.00  0.00           C  
HETATM   12  C   UNL     1       7.939  -1.441   0.940  1.00  0.00           C  
HETATM   13  C   UNL     1       5.685  -0.984   1.074  1.00  0.00           C  
HETATM   14  C   UNL     1       2.558   1.517  -0.368  1.00  0.00           C  
HETATM   15  N   UNL     1       3.279   2.282  -1.207  1.00  0.00           N  
HETATM   16  N   UNL     1       4.605   1.826  -1.125  1.00  0.00           N  
HETATM   17  C   UNL     1       4.610   0.834  -0.262  1.00  0.00           C  
HETATM   18  N   UNL     1       3.363   0.654   0.193  1.00  0.00           N  
HETATM   19  N   UNL     1      -5.429  -1.537   0.023  1.00  0.00           N  
HETATM   20  C   UNL     1      -5.931  -0.377   0.406  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.102   0.724   0.572  1.00  0.00           C  
HETATM   22  N   UNL     1      -3.807   0.619   0.355  1.00  0.00           N  
HETATM   23  C   UNL     1      -1.838  -0.662  -0.285  1.00  0.00           C  
HETATM   24  O   UNL     1      -1.367  -1.726  -0.637  1.00  0.00           O  
HETATM   25  N   UNL     1      -1.036   0.409  -0.122  1.00  0.00           N  
HETATM   26  O   UNL     1      -3.609  -2.842  -0.596  1.00  0.00           O  
HETATM   27  N   UNL     1       6.741  -1.682   1.437  1.00  0.00           N  
HETATM   28  H   UNL     1      -5.016  -4.126   0.206  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.272  -3.675  -1.497  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.980  -4.820  -1.064  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.191   2.519   1.855  1.00  0.00           H  
HETATM   32  H   UNL     1      -6.146   4.030   0.055  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.219   2.600  -1.107  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.774   1.385   0.486  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.702   2.815   1.648  1.00  0.00           H  
HETATM   36  H   UNL     1       0.571  -0.010  -1.404  1.00  0.00           H  
HETATM   37  H   UNL     1       0.826  -0.460   0.299  1.00  0.00           H  
HETATM   38  H   UNL     1       0.655   2.389  -0.782  1.00  0.00           H  
HETATM   39  H   UNL     1       0.911   1.939   0.921  1.00  0.00           H  
HETATM   40  H   UNL     1       7.181   1.115  -1.128  1.00  0.00           H  
HETATM   41  H   UNL     1       9.121  -0.248  -0.389  1.00  0.00           H  
HETATM   42  H   UNL     1       8.779  -2.037   1.265  1.00  0.00           H  
HETATM   43  H   UNL     1       4.720  -1.212   1.503  1.00  0.00           H  
HETATM   44  H   UNL     1       2.949   3.007  -1.761  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.991  -0.284   0.590  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.411   1.258   0.159  1.00  0.00           H  
CONECT    1   22    2    2   23                                       
CONECT    2   19    1    1   26                                       
CONECT    3   26   28   29   30                                       
CONECT    4   21    5    6   31                                       
CONECT    5    4    6   32   33                                       
CONECT    6    4    5   34   35                                       
CONECT    7   25    8   36   37                                       
CONECT    8   14    7   38   39                                       
CONECT    9   17   10   10   13                                       
CONECT   10    9    9   11   40                                       
CONECT   11   10   12   12   41                                       
CONECT   12   11   11   27   42                                       
CONECT   13    9   27   27   43                                       
CONECT   14   15   18   18    8                                       
CONECT   15   14   16   44                                            
CONECT   16   15   17   17                                            
CONECT   17   16   16   18    9                                       
CONECT   18   14   14   17                                            
CONECT   19   20   20    2                                            
CONECT   20   19   19   21   45                                       
CONECT   21   20   22   22    4                                       
CONECT   22   21   21    1                                            
CONECT   23    1   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23    7   46                                            
CONECT   26    2    3                                                 
CONECT   27   12   13   13                                            
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   15                                                      
CONECT   45   20                                                      
CONECT   46   25                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
