COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -8.714  -0.086   1.106  1.00  0.00           N  
HETATM    2  C   UNL     1      -7.495   0.173   0.490  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.419   1.137  -0.510  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.199   1.385  -1.114  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.075   2.420  -2.202  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.093   0.658  -0.696  1.00  0.00           C  
HETATM    7  N   UNL     1      -6.415  -0.495   0.866  1.00  0.00           N  
HETATM    8  C   UNL     1      -5.240  -0.283   0.304  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.043  -1.075   0.762  1.00  0.00           C  
HETATM   10  O   UNL     1      -2.891  -0.671   0.019  1.00  0.00           O  
HETATM   11  C   UNL     1       0.541  -0.660  -0.336  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.939  -0.594   1.482  1.00  0.00           C  
HETATM   13  N   UNL     1       0.497  -0.769   1.145  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.721  -1.407  -0.818  1.00  0.00           C  
HETATM   15  C   UNL     1       1.801  -1.332  -0.883  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.694  -1.364   0.378  1.00  0.00           C  
HETATM   17  O   UNL     1       2.954  -0.603  -0.456  1.00  0.00           O  
HETATM   18  C   UNL     1       4.191  -1.150  -0.916  1.00  0.00           C  
HETATM   19  C   UNL     1       5.332  -0.306  -0.410  1.00  0.00           C  
HETATM   20  N   UNL     1       6.573  -0.635  -0.719  1.00  0.00           N  
HETATM   21  C   UNL     1       7.606   0.077  -0.296  1.00  0.00           C  
HETATM   22  N   UNL     1       8.895  -0.305  -0.646  1.00  0.00           N  
HETATM   23  C   UNL     1       7.411   1.205   0.495  1.00  0.00           C  
HETATM   24  C   UNL     1       6.123   1.574   0.836  1.00  0.00           C  
HETATM   25  C   UNL     1       5.067   0.803   0.368  1.00  0.00           C  
HETATM   26  C   UNL     1       5.870   2.789   1.691  1.00  0.00           C  
HETATM   27  H   UNL     1       9.035  -1.090  -1.198  1.00  0.00           H  
HETATM   28  H   UNL     1       9.655   0.214  -0.339  1.00  0.00           H  
HETATM   29  H   UNL     1       8.256   1.784   0.839  1.00  0.00           H  
HETATM   30  H   UNL     1       5.753   3.665   1.053  1.00  0.00           H  
HETATM   31  H   UNL     1       4.961   2.640   2.274  1.00  0.00           H  
HETATM   32  H   UNL     1       6.713   2.941   2.365  1.00  0.00           H  
HETATM   33  H   UNL     1       4.049   1.065   0.615  1.00  0.00           H  
HETATM   34  H   UNL     1       4.299  -2.168  -0.544  1.00  0.00           H  
HETATM   35  H   UNL     1       4.202  -1.158  -2.006  1.00  0.00           H  
HETATM   36  H   UNL     1       1.859  -2.354  -0.510  1.00  0.00           H  
HETATM   37  H   UNL     1       1.762  -1.344  -1.973  1.00  0.00           H  
HETATM   38  H   UNL     1       0.503   0.386  -0.641  1.00  0.00           H  
HETATM   39  H   UNL     1       0.833  -1.670   1.451  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.156  -0.900  -1.679  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.477  -2.439  -1.070  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.155  -1.023   2.461  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.210   0.461   1.463  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.928  -2.375   0.713  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.872  -0.893   1.823  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.226  -2.137   0.600  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.126   0.828  -1.147  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.841   3.388  -1.758  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.277   2.133  -2.888  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.016   2.489  -2.748  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.300   1.683  -0.812  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.507   0.404   0.837  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.772  -0.759   1.802  1.00  0.00           H  
CONECT    1    2   52   53                                            
CONECT    2    3    3    7    1                                       
CONECT    3    4    2    2   51                                       
CONECT    4    6    6    5    3                                       
CONECT    5    4   48   49   50                                       
CONECT    6    8    4    4   47                                       
CONECT    7    8    8    2                                            
CONECT    8    9    6    7    7                                       
CONECT    9   10    8   45   46                                       
CONECT   10   16    9                                                 
CONECT   11   15   13   14   38                                       
CONECT   12   13   16   42   43                                       
CONECT   13   11   12   39                                            
CONECT   14   11   16   40   41                                       
CONECT   15   17   11   36   37                                       
CONECT   16   12   14   10   44                                       
CONECT   17   18   15                                                 
CONECT   18   19   17   34   35                                       
CONECT   19   20   25   25   18                                       
CONECT   20   21   21   19                                            
CONECT   21   22   20   20   23                                       
CONECT   22   21   27   28                                            
CONECT   23   21   24   24   29                                       
CONECT   24   23   23   26   25                                       
CONECT   25   24   19   19   33                                       
CONECT   26   24   30   31   32                                       
CONECT   27   22                                                      
CONECT   28   22                                                      
CONECT   29   23                                                      
CONECT   30   26                                                      
CONECT   31   26                                                      
CONECT   32   26                                                      
CONECT   33   25                                                      
CONECT   34   18                                                      
CONECT   35   18                                                      
CONECT   36   15                                                      
CONECT   37   15                                                      
CONECT   38   11                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   12                                                      
CONECT   43   12                                                      
CONECT   44   16                                                      
CONECT   45    9                                                      
CONECT   46    9                                                      
CONECT   47    6                                                      
CONECT   48    5                                                      
CONECT   49    5                                                      
CONECT   50    5                                                      
CONECT   51    3                                                      
CONECT   52    1                                                      
CONECT   53    1                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
