COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.974   0.924   0.844  1.00  0.00           C  
HETATM    2  C   UNL     1       2.064   1.048  -0.529  1.00  0.00           C  
HETATM    3  C   UNL     1       3.044   0.364  -1.222  1.00  0.00           C  
HETATM    4  C   UNL     1       3.936  -0.444  -0.541  1.00  0.00           C  
HETATM    5  C   UNL     1       3.847  -0.567   0.832  1.00  0.00           C  
HETATM    6  C   UNL     1       2.869   0.120   1.526  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.332   0.815   1.695  1.00  0.00           C  
HETATM    8  N   UNL     1      -1.315   0.922   0.749  1.00  0.00           N  
HETATM    9  C   UNL     1      -2.423   0.162   0.824  1.00  0.00           C  
HETATM   10  O   UNL     1      -3.284   0.273  -0.027  1.00  0.00           O  
HETATM   11  N   UNL     1      -2.592  -0.717   1.828  1.00  0.00           N  
HETATM   12  C   UNL     1      -1.645  -0.855   2.778  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.797  -1.651   3.687  1.00  0.00           O  
HETATM   14  C   UNL     1      -0.476  -0.058   2.713  1.00  0.00           C  
HETATM   15  C   UNL     1       0.905   1.670   1.600  1.00  0.00           C  
HETATM   16  C   UNL     1       0.595  -0.190   3.764  1.00  0.00           C  
HETATM   17  C   UNL     1       0.016   0.175   5.132  1.00  0.00           C  
HETATM   18  C   UNL     1       1.105  -1.632   3.795  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.159   1.871  -0.355  1.00  0.00           C  
HETATM   20  O   UNL     1      -0.499   1.226  -1.447  1.00  0.00           O  
HETATM   21  C   UNL     1      -1.519   0.652  -2.266  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.886  -0.045  -3.442  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.536  -1.379  -3.346  1.00  0.00           C  
HETATM   24  C   UNL     1       0.044  -2.020  -4.425  1.00  0.00           C  
HETATM   25  C   UNL     1       0.274  -1.327  -5.599  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.077   0.006  -5.694  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.661   0.645  -4.617  1.00  0.00           C  
HETATM   28  H   UNL     1       1.367   1.679  -1.060  1.00  0.00           H  
HETATM   29  H   UNL     1       3.114   0.460  -2.295  1.00  0.00           H  
HETATM   30  H   UNL     1       4.701  -0.979  -1.083  1.00  0.00           H  
HETATM   31  H   UNL     1       4.543  -1.199   1.364  1.00  0.00           H  
HETATM   32  H   UNL     1       2.799   0.024   2.599  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.397  -1.256   1.867  1.00  0.00           H  
HETATM   34  H   UNL     1       0.668   2.596   1.075  1.00  0.00           H  
HETATM   35  H   UNL     1       1.263   1.903   2.603  1.00  0.00           H  
HETATM   36  H   UNL     1       1.420   0.481   3.528  1.00  0.00           H  
HETATM   37  H   UNL     1       0.792   0.080   5.893  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.346   1.203   5.110  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.808  -0.496   5.369  1.00  0.00           H  
HETATM   40  H   UNL     1       0.280  -2.304   4.032  1.00  0.00           H  
HETATM   41  H   UNL     1       1.518  -1.892   2.821  1.00  0.00           H  
HETATM   42  H   UNL     1       1.881  -1.727   4.555  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.141   2.217  -0.678  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.564   2.721  -0.022  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.093  -0.066  -1.681  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.183   1.440  -2.625  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.715  -1.920  -2.429  1.00  0.00           H  
HETATM   48  H   UNL     1       0.319  -3.062  -4.350  1.00  0.00           H  
HETATM   49  H   UNL     1       0.728  -1.827  -6.441  1.00  0.00           H  
HETATM   50  H   UNL     1       0.102   0.547  -6.611  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.936   1.687  -4.692  1.00  0.00           H  
CONECT    1    2    2    6   15                                       
CONECT    2    1    1    3   28                                       
CONECT    3    2    4    4   29                                       
CONECT    4    3    3    5   30                                       
CONECT    5    4    6    6   31                                       
CONECT    6    1    5    5   32                                       
CONECT    7    8   14   14   15                                       
CONECT    8    7    9   19                                            
CONECT    9    8   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   12   33                                            
CONECT   12   11   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14    7    7   12   16                                       
CONECT   15    1    7   34   35                                       
CONECT   16   14   17   18   36                                       
CONECT   17   16   37   38   39                                       
CONECT   18   16   40   41   42                                       
CONECT   19    8   20   43   44                                       
CONECT   20   19   21                                                 
CONECT   21   20   22   45   46                                       
CONECT   22   21   23   23   27                                       
CONECT   23   22   22   24   47                                       
CONECT   24   23   25   25   48                                       
CONECT   25   24   24   26   49                                       
CONECT   26   25   27   27   50                                       
CONECT   27   22   26   26   51                                       
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33   11                                                      
CONECT   34   15                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   19                                                      
CONECT   45   21                                                      
CONECT   46   21                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
