COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.126   1.828   0.986  1.00  0.00           C  
HETATM    2  C   UNL     1       4.933   0.646   0.513  1.00  0.00           C  
HETATM    3  C   UNL     1       4.664  -0.634   1.025  1.00  0.00           C  
HETATM    4  N   UNL     1      -7.894  -0.414  -0.819  1.00  0.00           N  
HETATM    5  C   UNL     1       7.665  -0.342  -1.752  1.00  0.00           C  
HETATM    6  C   UNL     1       5.907   0.822  -0.405  1.00  0.00           C  
HETATM    7  C   UNL     1       1.753   1.270   0.621  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.261   0.505   0.751  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.681   0.208   0.472  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.295   0.737  -0.666  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.618   0.459  -0.925  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.346  -0.350  -0.052  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.734  -0.878   1.084  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.409  -0.607   1.343  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.370  -1.923  -0.337  1.00  0.00           C  
HETATM   16  C   UNL     1      -9.191   0.176  -1.159  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.743   0.264  -0.633  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.561   1.756  -0.737  1.00  0.00           C  
HETATM   19  N   UNL     1      -7.636  -1.776  -0.626  1.00  0.00           N  
HETATM   20  C   UNL     1      -5.772  -0.648  -0.333  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.747  -1.184   2.567  1.00  0.00           C  
HETATM   22  O   UNL     1       0.559   1.272   0.000  1.00  0.00           O  
HETATM   23  N   UNL     1       0.436   0.072   1.774  1.00  0.00           N  
HETATM   24  N   UNL     1       1.636   0.528   1.697  1.00  0.00           N  
HETATM   25  N   UNL     1       2.894   1.924   0.199  1.00  0.00           N  
HETATM   26  C   UNL     1       2.872   2.715  -1.034  1.00  0.00           C  
HETATM   27  N   UNL     1       6.643  -0.239  -0.849  1.00  0.00           N  
HETATM   28  C   UNL     1       8.023  -1.644  -1.803  1.00  0.00           C  
HETATM   29  N   UNL     1       7.250  -2.332  -0.959  1.00  0.00           N  
HETATM   30  C   UNL     1       6.404  -1.500  -0.368  1.00  0.00           C  
HETATM   31  C   UNL     1       5.394  -1.699   0.595  1.00  0.00           C  
HETATM   32  H   UNL     1       3.876   1.699   2.039  1.00  0.00           H  
HETATM   33  H   UNL     1       4.710   2.740   0.860  1.00  0.00           H  
HETATM   34  H   UNL     1       3.882  -0.772   1.756  1.00  0.00           H  
HETATM   35  H   UNL     1       8.104   0.465  -2.319  1.00  0.00           H  
HETATM   36  H   UNL     1       6.105   1.810  -0.792  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.732   1.364  -1.342  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.093   0.868  -1.804  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.298  -1.504   1.760  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.871  -2.859  -0.134  1.00  0.00           H  
HETATM   41  H   UNL     1      -9.295   0.226  -2.243  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.989  -0.441  -0.746  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.255   1.180  -0.741  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.736   2.212   0.238  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.545   1.977  -1.064  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.271   2.159  -1.459  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.866  -0.495   3.404  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.209  -2.139   2.814  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.685  -1.334   2.369  1.00  0.00           H  
HETATM   50  H   UNL     1       3.145   2.080  -1.877  1.00  0.00           H  
HETATM   51  H   UNL     1       1.871   3.116  -1.190  1.00  0.00           H  
HETATM   52  H   UNL     1       3.585   3.536  -0.952  1.00  0.00           H  
HETATM   53  H   UNL     1       8.804  -2.059  -2.422  1.00  0.00           H  
HETATM   54  H   UNL     1       5.196  -2.687   0.982  1.00  0.00           H  
CONECT    1    2   25   32   33                                       
CONECT    2    6    6    3    1                                       
CONECT    3   31   31    2   34                                       
CONECT    4   17   19   16                                            
CONECT    5   28   28   27   35                                       
CONECT    6   27    2    2   36                                       
CONECT    7   25   22   24   24                                       
CONECT    8   22   23   23    9                                       
CONECT    9    8   10   10   14                                       
CONECT   10    9    9   11   37                                       
CONECT   11   10   12   12   38                                       
CONECT   12   11   11   13   20                                       
CONECT   13   14   14   12   39                                       
CONECT   14    9   21   13   13                                       
CONECT   15   20   19   19   40                                       
CONECT   16    4   41   42   43                                       
CONECT   17   20   20   18    4                                       
CONECT   18   17   44   45   46                                       
CONECT   19   15   15    4                                            
CONECT   20   12   15   17   17                                       
CONECT   21   14   47   48   49                                       
CONECT   22    7    8                                                 
CONECT   23   24    8    8                                            
CONECT   24    7    7   23                                            
CONECT   25   26    1    7                                            
CONECT   26   25   50   51   52                                       
CONECT   27    5   30    6                                            
CONECT   28    5    5   29   53                                       
CONECT   29   28   30   30                                            
CONECT   30   29   29   27   31                                       
CONECT   31   30    3    3   54                                       
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    3                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37   10                                                      
CONECT   38   11                                                      
CONECT   39   13                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   26                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   28                                                      
CONECT   54   31                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
