COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.105  -0.241  -0.999  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.917  -0.463  -0.332  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.219  -1.728   0.199  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.539  -2.197   0.087  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.112  -1.362   0.562  1.00  0.00           C  
HETATM    6  N   UNL     1      -7.436  -1.424  -0.515  1.00  0.00           N  
HETATM    7  O   UNL     1       7.131  -1.398   0.198  1.00  0.00           O  
HETATM    8  O   UNL     1      -4.098   2.835   0.380  1.00  0.00           O  
HETATM    9  O   UNL     1       5.708  -1.622  -1.969  1.00  0.00           O  
HETATM   10  O   UNL     1      -1.904   4.000  -0.391  1.00  0.00           O  
HETATM   11  C   UNL     1      -1.645   2.848   0.414  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.698   1.879  -0.319  1.00  0.00           C  
HETATM   13  C   UNL     1       0.579   1.679   0.500  1.00  0.00           C  
HETATM   14  O   UNL     1       1.498   0.873  -0.240  1.00  0.00           O  
HETATM   15  P   UNL     1       2.950   0.461   0.320  1.00  0.00           P  
HETATM   16  O   UNL     1       3.698   1.681   0.697  1.00  0.00           O  
HETATM   17  O   UNL     1       2.779  -0.484   1.612  1.00  0.00           O  
HETATM   18  O   UNL     1       3.760  -0.333  -0.823  1.00  0.00           O  
HETATM   19  O   UNL     1       4.718  -1.865   1.051  1.00  0.00           O  
HETATM   20  O   UNL     1       5.911   0.890  -0.019  1.00  0.00           O  
HETATM   21  C   UNL     1      -2.942   2.029   0.620  1.00  0.00           C  
HETATM   22  O   UNL     1      -1.391   0.627  -0.457  1.00  0.00           O  
HETATM   23  N   UNL     1      -3.582  -0.260  -0.088  1.00  0.00           N  
HETATM   24  N   UNL     1      -4.074  -2.222   0.730  1.00  0.00           N  
HETATM   25  N   UNL     1      -6.896  -3.435   0.591  1.00  0.00           N  
HETATM   26  N   UNL     1      -5.882   0.239  -0.917  1.00  0.00           N  
HETATM   27  C   UNL     1      -2.804   0.925  -0.459  1.00  0.00           C  
HETATM   28  V   UNL     1       5.446  -0.866  -0.312  1.00  0.00           V  
HETATM   29  H   UNL     1      -7.864   0.354  -1.485  1.00  0.00           H  
HETATM   30  H   UNL     1      -6.232  -3.991   1.028  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.810  -3.748   0.507  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.093  -1.500   0.890  1.00  0.00           H  
HETATM   33  H   UNL     1       7.366  -1.148   1.103  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.179   3.592   0.975  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.973   1.595   1.620  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.494   4.644   0.022  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.221   3.143   1.374  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.449   2.277  -1.303  1.00  0.00           H  
HETATM   39  H   UNL     1       1.032   2.648   0.708  1.00  0.00           H  
HETATM   40  H   UNL     1       0.334   1.183   1.439  1.00  0.00           H  
HETATM   41  H   UNL     1       4.506  -2.775   0.801  1.00  0.00           H  
HETATM   42  H   UNL     1       6.286   1.332  -0.793  1.00  0.00           H  
HETATM   43  H   UNL     1       6.574  -2.040  -2.078  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.118   1.299  -1.433  1.00  0.00           H  
HETATM   45  H   UNL     1       2.297  -1.304   1.438  1.00  0.00           H  
CONECT    1    6   26   26   29                                       
CONECT    2    3    3   23   26                                       
CONECT    3    2    2    4   24                                       
CONECT    4    3    6    6   25                                       
CONECT    5   23   24   24   32                                       
CONECT    6    1    4    4                                            
CONECT    7   28   33                                                 
CONECT    8   21   34                                                 
CONECT    9   28   43                                                 
CONECT   10   11   36                                                 
CONECT   11   10   12   21   37                                       
CONECT   12   11   13   22   38                                       
CONECT   13   12   14   39   40                                       
CONECT   14   13   15                                                 
CONECT   15   14   16   16   17                                       
CONECT   15   18                                                      
CONECT   16   15   15                                                 
CONECT   17   15   45                                                 
CONECT   18   15   28                                                 
CONECT   19   28   41                                                 
CONECT   20   28   42                                                 
CONECT   21    8   11   27   35                                       
CONECT   22   12   27                                                 
CONECT   23    2    5   27                                            
CONECT   24    3    5    5                                            
CONECT   25    4   30   31                                            
CONECT   26    1    1    2                                            
CONECT   27   23   21   22   44                                       
CONECT   28    7    9   18   19                                       
CONECT   28   20                                                      
CONECT   29    1                                                      
CONECT   30   25                                                      
CONECT   31   25                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35   21                                                      
CONECT   36   10                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43    9                                                      
CONECT   44   27                                                      
CONECT   45   17                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
