COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.554   2.062  -1.743  1.00  0.00           C  
HETATM    2  C   UNL     1       4.876   1.254  -0.395  1.00  0.00           C  
HETATM    3  C   UNL     1       5.015   2.380   0.433  1.00  0.00           C  
HETATM    4  C   UNL     1       5.976   3.344   0.087  1.00  0.00           C  
HETATM    5  N   UNL     1       3.878   0.495   0.161  1.00  0.00           N  
HETATM    6  C   UNL     1       3.442   1.147   1.276  1.00  0.00           C  
HETATM    7  C   UNL     1       3.372  -0.781  -0.350  1.00  0.00           C  
HETATM    8  C   UNL     1       1.820  -2.437  -0.002  1.00  0.00           C  
HETATM    9  C   UNL     1       0.675  -2.889   0.906  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.678  -2.555   1.371  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.866  -1.795   0.950  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.814  -1.189   0.615  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.970  -0.449   0.205  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.681   0.273  -0.994  1.00  0.00           C  
HETATM   15  C   UNL     1      -8.533   1.503  -1.579  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.582   1.964   0.473  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.614   0.974   0.223  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.934  -2.923  -0.904  1.00  0.00           C  
HETATM   19  C   UNL     1       3.152  -3.069   0.457  1.00  0.00           C  
HETATM   20  C   UNL     1       4.197  -1.955   0.223  1.00  0.00           C  
HETATM   21  N   UNL     1       6.717   3.139  -0.997  1.00  0.00           N  
HETATM   22  N   UNL     1       5.660   1.137  -1.463  1.00  0.00           N  
HETATM   23  N   UNL     1       6.158   4.474   0.865  1.00  0.00           N  
HETATM   24  N   UNL     1       4.110   2.253   1.434  1.00  0.00           N  
HETATM   25  N   UNL     1      -0.594  -2.344   0.403  1.00  0.00           N  
HETATM   26  N   UNL     1      -5.638  -0.618  -0.982  1.00  0.00           N  
HETATM   27  N   UNL     1      -7.650   0.568  -1.856  1.00  0.00           N  
HETATM   28  N   UNL     1      -8.509   2.190  -0.451  1.00  0.00           N  
HETATM   29  N   UNL     1      -5.556   0.490   0.910  1.00  0.00           N  
HETATM   30  N   UNL     1      -7.565   2.689   1.652  1.00  0.00           N  
HETATM   31  O   UNL     1       2.026  -1.013   0.119  1.00  0.00           O  
HETATM   32  O   UNL     1       3.459  -4.220  -0.332  1.00  0.00           O  
HETATM   33  O   UNL     1       5.182  -2.382  -0.719  1.00  0.00           O  
HETATM   34  H   UNL     1       7.174   1.936  -2.618  1.00  0.00           H  
HETATM   35  H   UNL     1       2.658   0.798   1.931  1.00  0.00           H  
HETATM   36  H   UNL     1       3.401  -0.792  -1.439  1.00  0.00           H  
HETATM   37  H   UNL     1       1.610  -2.705  -1.038  1.00  0.00           H  
HETATM   38  H   UNL     1       0.625  -3.978   0.913  1.00  0.00           H  
HETATM   39  H   UNL     1       0.850  -2.527   1.919  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.358  -2.214   2.355  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.923  -3.616   1.417  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.307   1.717  -2.301  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.032  -4.004  -0.808  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.877  -2.502  -1.253  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.146  -2.692  -1.620  1.00  0.00           H  
HETATM   46  H   UNL     1       3.105  -3.333   1.514  1.00  0.00           H  
HETATM   47  H   UNL     1       4.668  -1.667   1.163  1.00  0.00           H  
HETATM   48  H   UNL     1       5.618   4.608   1.660  1.00  0.00           H  
HETATM   49  H   UNL     1       6.825   5.133   0.616  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.414  -1.250  -1.683  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.236   3.372   1.811  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.883   2.515   2.319  1.00  0.00           H  
HETATM   53  H   UNL     1       4.286  -4.657  -0.086  1.00  0.00           H  
HETATM   54  H   UNL     1       5.689  -3.155  -0.435  1.00  0.00           H  
CONECT    1   21   21   22   34                                       
CONECT    2    3    5   22   22                                       
CONECT    3   24    4    4    2                                       
CONECT    4   23    3    3   21                                       
CONECT    5    6    2    7                                            
CONECT    6   24   24    5   35                                       
CONECT    7   20    5   31   36                                       
CONECT    8   19   31    9   37                                       
CONECT    9    8   25   38   39                                       
CONECT   10   25   11   40   41                                       
CONECT   11   12   12   12   10                                       
CONECT   12   13   11   11   11                                       
CONECT   13   29   29   12   26                                       
CONECT   14   17   17   26   27                                       
CONECT   15   28   27   27   42                                       
CONECT   16   30   28   28   17                                       
CONECT   17   16   29   14   14                                       
CONECT   18   25   43   44   45                                       
CONECT   19   20   32    8   46                                       
CONECT   20   33   19    7   47                                       
CONECT   21    4    1    1                                            
CONECT   22    2    2    1                                            
CONECT   23    4   48   49                                            
CONECT   24    3    6    6                                            
CONECT   25    9   18   10                                            
CONECT   26   13   14   50                                            
CONECT   27   15   15   14                                            
CONECT   28   16   16   15                                            
CONECT   29   17   13   13                                            
CONECT   30   16   51   52                                            
CONECT   31    7    8                                                 
CONECT   32   19   53                                                 
CONECT   33   20   54                                                 
CONECT   34    1                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   15                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
CONECT   50   26                                                      
CONECT   51   30                                                      
CONECT   52   30                                                      
CONECT   53   32                                                      
CONECT   54   33                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
