COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.645   1.341   0.974  1.00  0.00           C  
HETATM    2  C   UNL     1       5.180  -0.069   0.603  1.00  0.00           C  
HETATM    3  C   UNL     1       3.701  -3.611   0.009  1.00  0.00           C  
HETATM    4  C   UNL     1       3.313   0.818  -0.663  1.00  0.00           C  
HETATM    5  C   UNL     1       3.723   2.254  -0.330  1.00  0.00           C  
HETATM    6  C   UNL     1       3.252  -1.360   0.222  1.00  0.00           C  
HETATM    7  C   UNL     1       2.354  -3.856  -0.175  1.00  0.00           C  
HETATM    8  C   UNL     1       1.471  -2.775  -0.152  1.00  0.00           C  
HETATM    9  C   UNL     1       5.240   2.315  -0.137  1.00  0.00           C  
HETATM   10  C   UNL     1       5.932   4.486  -0.881  1.00  0.00           C  
HETATM   11  O   UNL     1       5.622   3.643   0.230  1.00  0.00           O  
HETATM   12  N   UNL     1       3.721  -0.075   0.429  1.00  0.00           N  
HETATM   13  N   UNL     1       4.112  -2.367   0.205  1.00  0.00           N  
HETATM   14  N   UNL     1       1.953  -1.552   0.045  1.00  0.00           N  
HETATM   15  N   UNL     1       0.110  -2.974  -0.332  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.775  -1.904  -0.198  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.137  -2.135  -0.272  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.011  -1.051  -0.135  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.457   0.230   0.072  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.082   0.369   0.133  1.00  0.00           C  
HETATM   21  N   UNL     1      -0.296  -0.683   0.004  1.00  0.00           N  
HETATM   22  N   UNL     1      -3.529   1.099   0.166  1.00  0.00           N  
HETATM   23  C   UNL     1      -4.667   0.354   0.025  1.00  0.00           C  
HETATM   24  N   UNL     1      -4.354  -0.909  -0.153  1.00  0.00           N  
HETATM   25  C   UNL     1      -6.044   0.891   0.062  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.207   0.166  -0.077  1.00  0.00           C  
HETATM   27  N   UNL     1      -8.234   1.030   0.018  1.00  0.00           N  
HETATM   28  N   UNL     1      -7.714   2.314   0.219  1.00  0.00           N  
HETATM   29  C   UNL     1      -6.411   2.240   0.253  1.00  0.00           C  
HETATM   30  H   UNL     1       5.178   1.644   1.911  1.00  0.00           H  
HETATM   31  H   UNL     1       6.729   1.349   1.087  1.00  0.00           H  
HETATM   32  H   UNL     1       5.657  -0.376  -0.327  1.00  0.00           H  
HETATM   33  H   UNL     1       5.454  -0.762   1.398  1.00  0.00           H  
HETATM   34  H   UNL     1       4.411  -4.425  -0.003  1.00  0.00           H  
HETATM   35  H   UNL     1       2.231   0.768  -0.788  1.00  0.00           H  
HETATM   36  H   UNL     1       3.800   0.506  -1.587  1.00  0.00           H  
HETATM   37  H   UNL     1       3.433   2.914  -1.148  1.00  0.00           H  
HETATM   38  H   UNL     1       3.225   2.571   0.586  1.00  0.00           H  
HETATM   39  H   UNL     1       1.992  -4.862  -0.333  1.00  0.00           H  
HETATM   40  H   UNL     1       5.738   2.036  -1.065  1.00  0.00           H  
HETATM   41  H   UNL     1       6.212   5.475  -0.518  1.00  0.00           H  
HETATM   42  H   UNL     1       6.762   4.057  -1.442  1.00  0.00           H  
HETATM   43  H   UNL     1       5.060   4.570  -1.528  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.226  -3.857  -0.551  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.519  -3.133  -0.433  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.649   1.346   0.291  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.482   2.058   0.306  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.282  -0.900  -0.234  1.00  0.00           H  
HETATM   49  H   UNL     1      -9.175   0.803  -0.047  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.733   3.068   0.394  1.00  0.00           H  
CONECT    1    2    9   30   31                                       
CONECT    2    1   12   32   33                                       
CONECT    3    7    7   13   34                                       
CONECT    4   12    5   35   36                                       
CONECT    5    9    4   37   38                                       
CONECT    6   14   12   13   13                                       
CONECT    7    8    3    3   39                                       
CONECT    8   15   14   14    7                                       
CONECT    9    1   11    5   40                                       
CONECT   10   11   41   42   43                                       
CONECT   11   10    9                                                 
CONECT   12    2    6    4                                            
CONECT   13    6    6    3                                            
CONECT   14    8    8    6                                            
CONECT   15   16    8   44                                            
CONECT   16   21   17   17   15                                       
CONECT   17   18   16   16   45                                       
CONECT   18   24   19   19   17                                       
CONECT   19   22   20   18   18                                       
CONECT   20   19   21   21   46                                       
CONECT   21   20   20   16                                            
CONECT   22   23   19   47                                            
CONECT   23   25   22   24   24                                       
CONECT   24   23   23   18                                            
CONECT   25   26   26   29   23                                       
CONECT   26   27   25   25   48                                       
CONECT   27   28   26   49                                            
CONECT   28   27   29   29                                            
CONECT   29   28   28   25   50                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    7                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   15                                                      
CONECT   45   17                                                      
CONECT   46   20                                                      
CONECT   47   22                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   29                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
