COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.488   0.954  -0.069  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.411  -2.458  -0.001  1.00  0.00           C  
HETATM    3  C   UNL     1       0.152  -0.673   0.039  1.00  0.00           C  
HETATM    4  C   UNL     1       2.523   0.009   0.065  1.00  0.00           C  
HETATM    5  C   UNL     1       4.543  -0.989  -1.037  1.00  0.00           C  
HETATM    6  C   UNL     1       3.883  -0.638   0.125  1.00  0.00           C  
HETATM    7  C   UNL     1       4.489  -0.887   1.347  1.00  0.00           C  
HETATM    8  C   UNL     1       5.740  -1.484   1.354  1.00  0.00           C  
HETATM    9  C   UNL     1       6.339  -1.807   0.151  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.853  -1.655   0.057  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.087  -3.438   0.105  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.811   2.300  -0.127  1.00  0.00           N  
HETATM   13  N   UNL     1      -0.209   0.604  -0.024  1.00  0.00           N  
HETATM   14  C   UNL     1      -0.749   3.309  -0.146  1.00  0.00           C  
HETATM   15  N   UNL     1       1.488  -1.028   0.086  1.00  0.00           N  
HETATM   16  C   UNL     1       0.392   2.226  -2.087  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.264   3.513  -1.582  1.00  0.00           C  
HETATM   18  N   UNL     1       5.731  -1.560  -0.993  1.00  0.00           N  
HETATM   19  N   UNL     1      -0.859  -3.010   0.115  1.00  0.00           N  
HETATM   20  N   UNL     1      -2.948  -2.383   0.036  1.00  0.00           N  
HETATM   21  C   UNL     1      -4.849  -3.259  -1.229  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.918  -3.149   1.266  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.193  -1.238   0.003  1.00  0.00           C  
HETATM   24  N   UNL     1      -2.465   0.062  -0.053  1.00  0.00           N  
HETATM   25  C   UNL     1      -1.291   4.630   0.402  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.776   4.426   1.839  1.00  0.00           C  
HETATM   27  O   UNL     1      -0.255   5.614   0.385  1.00  0.00           O  
HETATM   28  H   UNL     1      -4.825  -1.452  -0.057  1.00  0.00           H  
HETATM   29  H   UNL     1       2.395   0.666   0.925  1.00  0.00           H  
HETATM   30  H   UNL     1       2.437   0.590  -0.853  1.00  0.00           H  
HETATM   31  H   UNL     1       4.078  -0.798  -1.993  1.00  0.00           H  
HETATM   32  H   UNL     1       3.997  -0.623   2.272  1.00  0.00           H  
HETATM   33  H   UNL     1       6.242  -1.692   2.288  1.00  0.00           H  
HETATM   34  H   UNL     1       7.314  -2.271   0.147  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.381  -4.477   0.143  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.741   2.574  -0.157  1.00  0.00           H  
HETATM   37  H   UNL     1       0.082   2.972   0.474  1.00  0.00           H  
HETATM   38  H   UNL     1       1.740  -1.964   0.132  1.00  0.00           H  
HETATM   39  H   UNL     1       0.737   2.371  -3.110  1.00  0.00           H  
HETATM   40  H   UNL     1       1.239   1.975  -1.449  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.335   1.413  -2.061  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.112   3.763  -2.220  1.00  0.00           H  
HETATM   43  H   UNL     1       0.463   4.325  -1.608  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.938  -3.315  -1.256  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.488  -2.767  -2.132  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.435  -4.266  -1.173  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.503  -4.156   1.322  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.605  -2.579   2.141  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.006  -3.205   1.239  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.122   4.967  -0.217  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.162   5.367   2.229  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.566   3.675   1.852  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.945   4.089   2.459  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.528   6.479   0.719  1.00  0.00           H  
CONECT    1   12   13   13   24                                       
CONECT    2   22   20   21   28                                       
CONECT    3   13   15   10   10                                       
CONECT    4    6   15   29   30                                       
CONECT    5   18    6    6   31                                       
CONECT    6    5    5    7    4                                       
CONECT    7    8    8    6   32                                       
CONECT    8    9    7    7   33                                       
CONECT    9   18   18    8   34                                       
CONECT   10    3    3   23   19                                       
CONECT   11   20   19   19   35                                       
CONECT   12   14    1   36                                            
CONECT   13    1    1    3                                            
CONECT   14   17   12   25   37                                       
CONECT   15    4    3   38                                            
CONECT   16   17   39   40   41                                       
CONECT   17   16   14   42   43                                       
CONECT   18    9    9    5                                            
CONECT   19   10   11   11                                            
CONECT   20   23    2   11                                            
CONECT   21    2   44   45   46                                       
CONECT   22    2   47   48   49                                       
CONECT   23   24   24   10   20                                       
CONECT   24    1   23   23                                            
CONECT   25   14   27   26   50                                       
CONECT   26   25   51   52   53                                       
CONECT   27   25   54                                                 
CONECT   28    2                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   17                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
