COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.430  -1.696   0.007  1.00  0.00           O  
HETATM    2  C   UNL     1       1.682  -0.507   0.019  1.00  0.00           C  
HETATM    3  N   UNL     1       2.964  -0.090   0.025  1.00  0.00           N  
HETATM    4  C   UNL     1       4.053  -1.069   0.018  1.00  0.00           C  
HETATM    5  C   UNL     1       5.377  -0.348   0.027  1.00  0.00           C  
HETATM    6  C   UNL     1       5.981  -0.030   1.229  1.00  0.00           C  
HETATM    7  C   UNL     1       7.195   0.632   1.237  1.00  0.00           C  
HETATM    8  C   UNL     1       7.805   0.973   0.045  1.00  0.00           C  
HETATM    9  C   UNL     1       7.200   0.654  -1.157  1.00  0.00           C  
HETATM   10  C   UNL     1       5.988  -0.011  -1.166  1.00  0.00           C  
HETATM   11  C   UNL     1       0.584   0.481   0.021  1.00  0.00           C  
HETATM   12  C   UNL     1       0.876   1.851   0.035  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.741   0.047   0.002  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.768   0.978   0.003  1.00  0.00           C  
HETATM   15  N   UNL     1      -3.091   0.579  -0.014  1.00  0.00           N  
HETATM   16  C   UNL     1      -3.730  -0.621  -0.034  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.092  -1.954  -0.044  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.419  -2.895   0.935  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.821  -4.138   0.920  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.898  -4.452  -0.062  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.569  -3.525  -1.035  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.165  -2.281  -1.035  1.00  0.00           C  
HETATM   23  N   UNL     1      -5.028  -0.373  -0.043  1.00  0.00           N  
HETATM   24  N   UNL     1      -5.234   0.898  -0.030  1.00  0.00           N  
HETATM   25  C   UNL     1      -4.079   1.537  -0.012  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.719   2.903   0.008  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.796   3.956   0.011  1.00  0.00           C  
HETATM   28  N   UNL     1      -2.464   3.264   0.025  1.00  0.00           N  
HETATM   29  C   UNL     1      -1.467   2.354   0.023  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.128   2.771   0.036  1.00  0.00           C  
HETATM   31  H   UNL     1       3.165   0.859   0.035  1.00  0.00           H  
HETATM   32  H   UNL     1       3.978  -1.703   0.901  1.00  0.00           H  
HETATM   33  H   UNL     1       3.981  -1.685  -0.878  1.00  0.00           H  
HETATM   34  H   UNL     1       5.505  -0.297   2.161  1.00  0.00           H  
HETATM   35  H   UNL     1       5.518  -0.264  -2.104  1.00  0.00           H  
HETATM   36  H   UNL     1       7.668   0.881   2.176  1.00  0.00           H  
HETATM   37  H   UNL     1       8.753   1.490   0.052  1.00  0.00           H  
HETATM   38  H   UNL     1       7.676   0.921  -2.089  1.00  0.00           H  
HETATM   39  H   UNL     1       1.904   2.180   0.045  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.966  -1.009  -0.013  1.00  0.00           H  
HETATM   41  H   UNL     1       0.107   3.825   0.047  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.139  -2.650   1.702  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.911  -1.559  -1.797  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.072  -4.866   1.676  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.431  -5.427  -0.069  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.848  -3.777  -1.798  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.066   4.198   1.039  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.429   4.853  -0.489  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.674   3.580  -0.516  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   11                                       
CONECT    3    2    4   31                                            
CONECT    4    3    5   32   33                                       
CONECT    5    4    6   10   10                                       
CONECT    6    5    7    7   34                                       
CONECT    7    6    6    8   36                                       
CONECT    8    7    9    9   37                                       
CONECT    9    8    8   10   38                                       
CONECT   10    5    5    9   35                                       
CONECT   11    2   12   13   13                                       
CONECT   12   11   30   30   39                                       
CONECT   13   11   11   14   40                                       
CONECT   14   13   15   29   29                                       
CONECT   15   14   16   25                                            
CONECT   16   15   17   23   23                                       
CONECT   17   16   18   22   22                                       
CONECT   18   17   19   19   42                                       
CONECT   19   18   18   20   44                                       
CONECT   20   19   21   21   45                                       
CONECT   21   20   20   22   46                                       
CONECT   22   17   17   21   43                                       
CONECT   23   16   16   24                                            
CONECT   24   23   25   25                                            
CONECT   25   15   24   24   26                                       
CONECT   26   25   27   28   28                                       
CONECT   27   26   47   48   49                                       
CONECT   28   26   26   29                                            
CONECT   29   14   14   28   30                                       
CONECT   30   12   12   29   41                                       
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    6                                                      
CONECT   35   10                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   30                                                      
CONECT   42   18                                                      
CONECT   43   22                                                      
CONECT   44   19                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   27                                                      
CONECT   48   27                                                      
CONECT   49   27                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
