COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -8.617   0.775  -1.564  1.00  0.00           C  
HETATM    2  C   UNL     1      -8.819   0.755  -0.047  1.00  0.00           C  
HETATM    3  C   UNL     1      -8.061  -0.384  -0.733  1.00  0.00           C  
HETATM    4  C   UNL     1     -10.226   0.454   0.474  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.603  -0.444  -0.540  1.00  0.00           C  
HETATM    6  C   UNL     1       5.565  -0.863  -0.714  1.00  0.00           C  
HETATM    7  C   UNL     1       4.948   0.056   0.342  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.441  -0.492  -0.386  1.00  0.00           C  
HETATM    9  C   UNL     1       5.078  -2.296  -0.489  1.00  0.00           C  
HETATM   10  C   UNL     1       5.143  -0.394  -2.108  1.00  0.00           C  
HETATM   11  C   UNL     1       5.530   1.439   0.205  1.00  0.00           C  
HETATM   12  C   UNL     1       2.705  -0.828   0.695  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.077  -0.548  -0.204  1.00  0.00           C  
HETATM   14  C   UNL     1       1.243  -0.768   0.501  1.00  0.00           C  
HETATM   15  C   UNL     1       0.422  -1.748   1.068  1.00  0.00           C  
HETATM   16  C   UNL     1       0.679   0.272  -0.245  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.496  -0.655   0.138  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.914  -0.596  -0.050  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.931  -1.692   0.889  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.674   0.332  -0.420  1.00  0.00           C  
HETATM   21  N   UNL     1       3.497   0.116   0.149  1.00  0.00           N  
HETATM   22  N   UNL     1       7.029  -0.821  -0.605  1.00  0.00           N  
HETATM   23  N   UNL     1       6.780   1.691   0.642  1.00  0.00           N  
HETATM   24  O   UNL     1     -10.725   1.592   1.180  1.00  0.00           O  
HETATM   25  O   UNL     1       4.874   2.327  -0.298  1.00  0.00           O  
HETATM   26  O   UNL     1       3.195  -1.730   1.347  1.00  0.00           O  
HETATM   27  O   UNL     1       7.356   2.969   0.443  1.00  0.00           O  
HETATM   28  H   UNL     1      -9.486   0.574  -2.190  1.00  0.00           H  
HETATM   29  H   UNL     1      -7.902   1.493  -1.967  1.00  0.00           H  
HETATM   30  H   UNL     1      -8.238   1.459   0.547  1.00  0.00           H  
HETATM   31  H   UNL     1      -8.565  -1.347  -0.813  1.00  0.00           H  
HETATM   32  H   UNL     1     -10.884   0.230  -0.365  1.00  0.00           H  
HETATM   33  H   UNL     1     -10.189  -0.403   1.146  1.00  0.00           H  
HETATM   34  H   UNL     1       5.166  -0.334   1.336  1.00  0.00           H  
HETATM   35  H   UNL     1       5.378  -2.631   0.504  1.00  0.00           H  
HETATM   36  H   UNL     1       3.992  -2.328  -0.570  1.00  0.00           H  
HETATM   37  H   UNL     1       5.518  -2.952  -1.242  1.00  0.00           H  
HETATM   38  H   UNL     1       5.583  -1.049  -2.860  1.00  0.00           H  
HETATM   39  H   UNL     1       4.057  -0.426  -2.189  1.00  0.00           H  
HETATM   40  H   UNL     1       5.490   0.627  -2.268  1.00  0.00           H  
HETATM   41  H   UNL     1       0.858  -2.549   1.646  1.00  0.00           H  
HETATM   42  H   UNL     1       1.314   1.029  -0.682  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.564  -2.454   1.320  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.109   1.133  -0.999  1.00  0.00           H  
HETATM   45  H   UNL     1       3.106   0.835  -0.372  1.00  0.00           H  
HETATM   46  H   UNL     1       7.368   0.128  -0.655  1.00  0.00           H  
HETATM   47  H   UNL     1       7.342  -1.272   0.241  1.00  0.00           H  
HETATM   48  H   UNL     1       7.285   0.996   1.093  1.00  0.00           H  
HETATM   49  H   UNL     1     -11.615   1.472   1.540  1.00  0.00           H  
HETATM   50  H   UNL     1       8.255   3.053   0.791  1.00  0.00           H  
CONECT    1    2    3   28   29                                       
CONECT    2    4    1    3   30                                       
CONECT    3    2    1    5   31                                       
CONECT    4   24    2   32   33                                       
CONECT    5    3    8    8    8                                       
CONECT    6   10   22    7    9                                       
CONECT    7   21    6   11   34                                       
CONECT    8    5    5    5   13                                       
CONECT    9    6   35   36   37                                       
CONECT   10    6   38   39   40                                       
CONECT   11   25   25    7   23                                       
CONECT   12   14   21   26   26                                       
CONECT   13    8   18   18   18                                       
CONECT   14   16   16   15   12                                       
CONECT   15   19   19   14   41                                       
CONECT   16   20   14   14   42                                       
CONECT   17   18   20   20   19                                       
CONECT   18   13   13   13   17                                       
CONECT   19   17   15   15   43                                       
CONECT   20   17   17   16   44                                       
CONECT   21   12    7   45                                            
CONECT   22    6   46   47                                            
CONECT   23   11   27   48                                            
CONECT   24    4   49                                                 
CONECT   25   11   11                                                 
CONECT   26   12   12                                                 
CONECT   27   23   50                                                 
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   24                                                      
CONECT   50   27                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
