COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.975   0.663  -0.339  1.00  0.00           C  
HETATM    2  C   UNL     1       0.604  -0.720   1.128  1.00  0.00           C  
HETATM    3  C   UNL     1       0.707  -0.884   2.645  1.00  0.00           C  
HETATM    4  N   UNL     1       1.526   0.328   0.685  1.00  0.00           N  
HETATM    5  C   UNL     1      -2.977  -0.952  -0.054  1.00  0.00           C  
HETATM    6  N   UNL     1       3.665   0.993   0.028  1.00  0.00           N  
HETATM    7  N   UNL     1      -6.793   1.589  -0.205  1.00  0.00           N  
HETATM    8  C   UNL     1      -0.806  -0.337   0.759  1.00  0.00           C  
HETATM    9  O   UNL     1       3.214  -1.112   0.576  1.00  0.00           O  
HETATM   10  C   UNL     1       2.816   0.029   0.435  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.334  -3.230  -0.631  1.00  0.00           C  
HETATM   12  C   UNL     1       7.302   1.230  -0.465  1.00  0.00           C  
HETATM   13  C   UNL     1       7.564   0.012  -1.064  1.00  0.00           C  
HETATM   14  C   UNL     1       6.535  -0.879  -1.306  1.00  0.00           C  
HETATM   15  C   UNL     1       5.241  -0.557  -0.945  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.220   0.977   0.895  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.512   1.336   0.570  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.401   0.375   0.087  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.783   0.755  -0.273  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.653   1.464   0.491  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.654   0.989  -1.354  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.679  -1.299   0.286  1.00  0.00           C  
HETATM   23  C   UNL     1       6.010   1.558  -0.102  1.00  0.00           C  
HETATM   24  O   UNL     1      -3.835  -1.897  -0.518  1.00  0.00           O  
HETATM   25  O   UNL     1      -5.423   0.463  -1.427  1.00  0.00           O  
HETATM   26  H   UNL     1       0.863  -1.661   0.642  1.00  0.00           H  
HETATM   27  H   UNL     1       0.448   0.057   3.131  1.00  0.00           H  
HETATM   28  H   UNL     1       0.021  -1.664   2.974  1.00  0.00           H  
HETATM   29  H   UNL     1       1.727  -1.161   2.912  1.00  0.00           H  
HETATM   30  H   UNL     1       1.209   1.238   0.572  1.00  0.00           H  
HETATM   31  H   UNL     1       3.369   1.916  -0.011  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.486  -3.243  -1.316  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.013  -3.582   0.350  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.119  -3.883  -1.012  1.00  0.00           H  
HETATM   35  H   UNL     1       8.107   1.925  -0.281  1.00  0.00           H  
HETATM   36  H   UNL     1       8.575  -0.243  -1.347  1.00  0.00           H  
HETATM   37  H   UNL     1       6.743  -1.830  -1.775  1.00  0.00           H  
HETATM   38  H   UNL     1       4.438  -1.254  -1.135  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.532   1.722   1.265  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.832   2.362   0.678  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.461   1.857   1.479  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.409   0.925  -2.123  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.350  -2.322   0.182  1.00  0.00           H  
HETATM   44  H   UNL     1       5.806   2.510   0.366  1.00  0.00           H  
CONECT    1   23   23   15    6                                       
CONECT    2    4    8    3   26                                       
CONECT    3    2   27   28   29                                       
CONECT    4   10    2   30                                            
CONECT    5   18   18   22   24                                       
CONECT    6    1   10   31                                            
CONECT    7   21   21   20                                            
CONECT    8   16    2   22   22                                       
CONECT    9   10   10                                                 
CONECT   10    6    9    9    4                                       
CONECT   11   24   32   33   34                                       
CONECT   12   13   13   23   35                                       
CONECT   13   12   12   14   36                                       
CONECT   14   13   15   15   37                                       
CONECT   15   14   14    1   38                                       
CONECT   16   17   17    8   39                                       
CONECT   17   16   16   18   40                                       
CONECT   18   17   19    5    5                                       
CONECT   19   25   18   20   20                                       
CONECT   20    7   19   19   41                                       
CONECT   21   25    7    7   42                                       
CONECT   22    8    8    5   43                                       
CONECT   23   12    1    1   44                                       
CONECT   24    5   11                                                 
CONECT   25   21   19                                                 
CONECT   26    2                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    6                                                      
CONECT   32   11                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
MASTER        0    0    0    0    0    0    0    0   44    0   44    0
END
