COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.088  -3.619  -0.670  1.00  0.00           O  
HETATM    2  C   UNL     1      -0.364  -2.438  -0.547  1.00  0.00           C  
HETATM    3  N   UNL     1      -1.595  -1.881  -0.554  1.00  0.00           N  
HETATM    4  C   UNL     1      -2.864  -2.595  -0.712  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.381  -3.007   0.642  1.00  0.00           C  
HETATM    6  O   UNL     1      -2.754  -2.731   1.638  1.00  0.00           O  
HETATM    7  C   UNL     1       0.572  -1.321  -0.354  1.00  0.00           C  
HETATM    8  N   UNL     1      -0.183  -0.204  -0.269  1.00  0.00           N  
HETATM    9  C   UNL     1      -1.446  -0.521  -0.384  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.556   0.442  -0.337  1.00  0.00           C  
HETATM   11  N   UNL     1      -3.778   0.029  -0.458  1.00  0.00           N  
HETATM   12  C   UNL     1      -2.273   1.911  -0.147  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.591   2.687  -0.134  1.00  0.00           C  
HETATM   14  C   UNL     1       1.958  -1.399  -0.274  1.00  0.00           C  
HETATM   15  C   UNL     1       2.720  -0.228  -0.085  1.00  0.00           C  
HETATM   16  C   UNL     1       2.242   1.065   0.039  1.00  0.00           C  
HETATM   17  N   UNL     1       3.274   1.913   0.206  1.00  0.00           N  
HETATM   18  C   UNL     1       4.475   1.230   0.201  1.00  0.00           C  
HETATM   19  C   UNL     1       4.190  -0.134   0.026  1.00  0.00           C  
HETATM   20  C   UNL     1       5.798   1.637   0.334  1.00  0.00           C  
HETATM   21  C   UNL     1       6.813   0.705   0.288  1.00  0.00           C  
HETATM   22  C   UNL     1       6.529  -0.640   0.109  1.00  0.00           C  
HETATM   23  C   UNL     1       5.223  -1.065  -0.011  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.308   4.155   0.056  1.00  0.00           C  
HETATM   25  N   UNL     1      -4.326   5.037   0.099  1.00  0.00           N  
HETATM   26  O   UNL     1      -2.164   4.542   0.169  1.00  0.00           O  
HETATM   27  H   UNL     1      -3.591  -1.943  -1.196  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.707  -3.482  -1.326  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.510   0.664  -0.427  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.753   2.061   0.799  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.648   2.269  -0.966  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.111   2.536  -1.080  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.216   2.329   0.684  1.00  0.00           H  
HETATM   34  H   UNL     1       2.450  -2.357  -0.356  1.00  0.00           H  
HETATM   35  H   UNL     1       1.201   1.350   0.006  1.00  0.00           H  
HETATM   36  H   UNL     1       3.187   2.873   0.315  1.00  0.00           H  
HETATM   37  H   UNL     1       6.030   2.682   0.474  1.00  0.00           H  
HETATM   38  H   UNL     1       7.839   1.026   0.391  1.00  0.00           H  
HETATM   39  H   UNL     1       7.334  -1.360   0.075  1.00  0.00           H  
HETATM   40  H   UNL     1       5.003  -2.113  -0.148  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.240   4.728   0.008  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.143   5.982   0.221  1.00  0.00           H  
HETATM   43  O   UNL     1      -4.539  -3.679   0.743  1.00  0.00           O  
HETATM   44  H   UNL     1      -4.830  -3.921   1.632  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    7                                       
CONECT    3    4    2    9                                            
CONECT    4    5    3   27   28                                       
CONECT    5    6    6    4   43                                       
CONECT    6    5    5                                                 
CONECT    7    2    8   14   14                                       
CONECT    8    9    9    7                                            
CONECT    9    3   10    8    8                                       
CONECT   10   11   11    9   12                                       
CONECT   11   10   10   29                                            
CONECT   12   10   13   30   31                                       
CONECT   13   12   24   32   33                                       
CONECT   14    7    7   15   34                                       
CONECT   15   14   16   16   19                                       
CONECT   16   15   15   17   35                                       
CONECT   17   16   18   36                                            
CONECT   18   19   17   20   20                                       
CONECT   19   15   23   23   18                                       
CONECT   20   18   18   21   37                                       
CONECT   21   22   22   20   38                                       
CONECT   22   23   21   21   39                                       
CONECT   23   19   19   22   40                                       
CONECT   24   13   25   26   26                                       
CONECT   25   24   41   42                                            
CONECT   26   24   24                                                 
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   12                                                      
CONECT   32   13                                                      
CONECT   33   13                                                      
CONECT   34   14                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   20                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
CONECT   40   23                                                      
CONECT   41   25                                                      
CONECT   42   25                                                      
CONECT   43    5   44                                                 
CONECT   44   43                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
