COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       7.273   1.573  -1.681  1.00  0.00           C  
HETATM    2  C   UNL     1       5.528   0.895  -0.337  1.00  0.00           C  
HETATM    3  C   UNL     1       6.051   1.621   0.737  1.00  0.00           C  
HETATM    4  C   UNL     1       7.256   2.342   0.540  1.00  0.00           C  
HETATM    5  O   UNL     1       7.752   2.991   1.445  1.00  0.00           O  
HETATM    6  C   UNL     1       3.487  -0.564  -0.641  1.00  0.00           C  
HETATM    7  C   UNL     1       3.950  -2.035  -0.549  1.00  0.00           C  
HETATM    8  C   UNL     1       2.633  -2.840  -0.484  1.00  0.00           C  
HETATM    9  C   UNL     1       1.530  -1.760  -0.544  1.00  0.00           C  
HETATM   10  C   UNL     1       0.358  -2.145   0.361  1.00  0.00           C  
HETATM   11  C   UNL     1       4.236   0.665   1.431  1.00  0.00           C  
HETATM   12  N   UNL     1       7.834   2.299  -0.681  1.00  0.00           N  
HETATM   13  N   UNL     1       6.168   0.901  -1.515  1.00  0.00           N  
HETATM   14  N   UNL     1       5.218   1.442   1.788  1.00  0.00           N  
HETATM   15  N   UNL     1       4.386   0.302   0.126  1.00  0.00           N  
HETATM   16  O   UNL     1      -2.704  -2.617   0.775  1.00  0.00           O  
HETATM   17  O   UNL     1      -5.396  -1.162   0.508  1.00  0.00           O  
HETATM   18  O   UNL     1      -7.458   0.343  -1.199  1.00  0.00           O  
HETATM   19  O   UNL     1       4.704  -2.396  -1.708  1.00  0.00           O  
HETATM   20  O   UNL     1      -1.816  -1.093   2.580  1.00  0.00           O  
HETATM   21  O   UNL     1      -4.973   0.766   2.081  1.00  0.00           O  
HETATM   22  O   UNL     1      -7.292   2.620  -0.123  1.00  0.00           O  
HETATM   23  O   UNL     1       2.530  -3.724  -1.602  1.00  0.00           O  
HETATM   24  O   UNL     1      -3.089  -0.139   0.487  1.00  0.00           O  
HETATM   25  O   UNL     1      -5.160   1.133  -0.515  1.00  0.00           O  
HETATM   26  O   UNL     1      -6.419   2.193  -2.565  1.00  0.00           O  
HETATM   27  O   UNL     1       2.165  -0.557  -0.060  1.00  0.00           O  
HETATM   28  O   UNL     1      -0.698  -1.195   0.203  1.00  0.00           O  
HETATM   29  P   UNL     1      -2.090  -1.290   1.006  1.00  0.00           P  
HETATM   30  P   UNL     1      -4.670   0.121   0.637  1.00  0.00           P  
HETATM   31  P   UNL     1      -6.601   1.546  -1.103  1.00  0.00           P  
HETATM   32  H   UNL     1       7.755   1.556  -2.647  1.00  0.00           H  
HETATM   33  H   UNL     1       3.446  -0.242  -1.681  1.00  0.00           H  
HETATM   34  H   UNL     1       4.540  -2.194   0.354  1.00  0.00           H  
HETATM   35  H   UNL     1       2.572  -3.397   0.451  1.00  0.00           H  
HETATM   36  H   UNL     1       1.187  -1.624  -1.570  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.002  -3.137   0.088  1.00  0.00           H  
HETATM   38  H   UNL     1       0.688  -2.152   1.400  1.00  0.00           H  
HETATM   39  H   UNL     1       3.425   0.355   2.073  1.00  0.00           H  
HETATM   40  H   UNL     1       5.020  -3.310  -1.703  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.414  -0.243   2.806  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.529   1.611   2.236  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.785   3.435  -0.012  1.00  0.00           H  
HETATM   44  H   UNL     1       3.234  -4.385  -1.647  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.248   2.466  -2.981  1.00  0.00           H  
HETATM   46  H   UNL     1       8.655   2.790  -0.843  1.00  0.00           H  
CONECT    1   13   13   12   32                                       
CONECT    2   15   13    3    3                                       
CONECT    3    2    2   14    4                                       
CONECT    4    3   12    5    5                                       
CONECT    5    4    4                                                 
CONECT    6    7   15   27   33                                       
CONECT    7   19    8    6   34                                       
CONECT    8   23    7    9   35                                       
CONECT    9    8   10   27   36                                       
CONECT   10   28    9   37   38                                       
CONECT   11   15   14   14   39                                       
CONECT   12    1    4   46                                            
CONECT   13    2    1    1                                            
CONECT   14   11   11    3                                            
CONECT   15    6   11    2                                            
CONECT   16   29   29                                                 
CONECT   17   30   30                                                 
CONECT   18   31   31                                                 
CONECT   19    7   40                                                 
CONECT   20   29   41                                                 
CONECT   21   30   42                                                 
CONECT   22   31   43                                                 
CONECT   23    8   44                                                 
CONECT   24   30   29                                                 
CONECT   25   31   30                                                 
CONECT   26   31   45                                                 
CONECT   27    6    9                                                 
CONECT   28   29   10                                                 
CONECT   29   24   16   16   28                                       
CONECT   29   20                                                      
CONECT   30   25   17   17   21                                       
CONECT   30   24                                                      
CONECT   31   18   18   26   25                                       
CONECT   31   22                                                      
CONECT   32    1                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   26                                                      
CONECT   46   12                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
