COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.175  -0.181  -0.260  1.00  0.00           C  
HETATM    2  C   UNL     1       5.034   0.873   0.094  1.00  0.00           C  
HETATM    3  C   UNL     1       6.417   0.624   0.112  1.00  0.00           C  
HETATM    4  C   UNL     1       3.006   1.635   0.181  1.00  0.00           C  
HETATM    5  N   UNL     1       6.845  -0.593  -0.206  1.00  0.00           N  
HETATM    6  N   UNL     1       4.696  -1.365  -0.563  1.00  0.00           N  
HETATM    7  C   UNL     1       5.999  -1.552  -0.533  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.859   0.507   0.858  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.089  -1.170  -0.713  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.568   1.312   0.687  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.776  -0.416  -0.931  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.140   1.163   0.110  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.782   0.733  -0.328  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.421   0.359   0.342  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.356  -1.032   0.733  1.00  0.00           C  
HETATM   16  C   UNL     1       1.184  -1.157   0.782  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.628  -0.211  -0.547  1.00  0.00           C  
HETATM   18  C   UNL     1       1.662  -0.397  -0.475  1.00  0.00           C  
HETATM   19  N   UNL     1       7.311   1.624   0.453  1.00  0.00           N  
HETATM   20  N   UNL     1       4.256   1.952   0.351  1.00  0.00           N  
HETATM   21  N   UNL     1       2.903   0.328  -0.191  1.00  0.00           N  
HETATM   22  N   UNL     1      -8.156  -0.215  -0.386  1.00  0.00           N  
HETATM   23  N   UNL     1      -3.018   0.246  -0.103  1.00  0.00           N  
HETATM   24  O   UNL     1      -1.599   1.932  -0.356  1.00  0.00           O  
HETATM   25  O   UNL     1      -0.959  -2.324   0.637  1.00  0.00           O  
HETATM   26  O   UNL     1       1.578  -2.529   0.718  1.00  0.00           O  
HETATM   27  O   UNL     1       0.590   0.529  -0.777  1.00  0.00           O  
HETATM   28  H   UNL     1       2.172   2.309   0.316  1.00  0.00           H  
HETATM   29  H   UNL     1       6.391  -2.527  -0.784  1.00  0.00           H  
HETATM   30  H   UNL     1      -7.736  -0.207   1.672  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.681   1.184   1.090  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.353  -1.711  -1.622  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.971  -1.876   0.109  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.695   2.036  -0.118  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.340   1.835   1.615  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.981  -1.126  -1.158  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.890   0.281  -1.761  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.263   1.797  -0.769  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.940   1.787   0.981  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.268  -0.340   1.164  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.724  -0.504   1.612  1.00  0.00           H  
HETATM   42  H   UNL     1       1.576  -0.689   1.685  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.836  -0.875  -1.387  1.00  0.00           H  
HETATM   44  H   UNL     1       1.809  -1.090  -1.304  1.00  0.00           H  
HETATM   45  H   UNL     1       6.986   2.508   0.683  1.00  0.00           H  
HETATM   46  H   UNL     1       8.264   1.440   0.462  1.00  0.00           H  
HETATM   47  H   UNL     1      -9.051  -0.677  -0.331  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.165  -0.713  -0.081  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.924  -2.303   0.573  1.00  0.00           H  
HETATM   50  H   UNL     1       1.252  -3.066   1.454  1.00  0.00           H  
CONECT    1    2   21    6    6                                       
CONECT    2   20    3    3    1                                       
CONECT    3   19    2    2    5                                       
CONECT    4   20   20   21   28                                       
CONECT    5    3    7    7                                            
CONECT    6    1    1    7                                            
CONECT    7    5    5    6   29                                       
CONECT    8   10   22   30   31                                       
CONECT    9   22   11   32   33                                       
CONECT   10    8   14   34   35                                       
CONECT   11   14    9   36   37                                       
CONECT   12   14   23   38   39                                       
CONECT   13   24   24   23   17                                       
CONECT   14   10   12   11   40                                       
CONECT   15   16   17   25   41                                       
CONECT   16   15   26   18   42                                       
CONECT   17   13   15   27   43                                       
CONECT   18   21   16   27   44                                       
CONECT   19    3   45   46                                            
CONECT   20    4    4    2                                            
CONECT   21    4   18    1                                            
CONECT   22    8    9   47                                            
CONECT   23   12   13   48                                            
CONECT   24   13   13                                                 
CONECT   25   15   49                                                 
CONECT   26   16   50                                                 
CONECT   27   17   18                                                 
CONECT   28    4                                                      
CONECT   29    7                                                      
CONECT   30    8                                                      
CONECT   31    8                                                      
CONECT   32    9                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
