COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1       1.550   2.515  -0.009  1.00  0.00           C  
HETATM    2  C   UNL     1       1.959   1.064  -0.011  1.00  0.00           C  
HETATM    3  C   UNL     1       3.328   0.691  -0.023  1.00  0.00           C  
HETATM    4  C   UNL     1       4.329   1.656   0.158  1.00  0.00           C  
HETATM    5  C   UNL     1       5.640   1.279   0.178  1.00  0.00           C  
HETATM    6  C   UNL     1       5.994  -0.058   0.007  1.00  0.00           C  
HETATM    7  O   UNL     1       7.302  -0.419   0.045  1.00  0.00           O  
HETATM    8  C   UNL     1       5.020  -1.022  -0.200  1.00  0.00           C  
HETATM    9  C   UNL     1       3.684  -0.656  -0.232  1.00  0.00           C  
HETATM   10  O   UNL     1       2.729  -1.583  -0.486  1.00  0.00           O  
HETATM   11  C   UNL     1       1.503  -1.337   0.027  1.00  0.00           C  
HETATM   12  O   UNL     1       0.828  -2.234   0.498  1.00  0.00           O  
HETATM   13  C   UNL     1       1.009   0.052   0.005  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.430   0.354  -0.006  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.327  -0.649   0.010  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.768  -0.347  -0.001  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.703  -1.387   0.015  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.050  -1.100   0.005  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.058  -2.220   0.023  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.481   0.220  -0.021  1.00  0.00           C  
HETATM   21  O   UNL     1      -6.811   0.498  -0.031  1.00  0.00           O  
HETATM   22  C   UNL     1      -4.557   1.257  -0.037  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.031   2.687  -0.064  1.00  0.00           C  
HETATM   24  C   UNL     1      -3.207   0.980  -0.021  1.00  0.00           C  
HETATM   25  H   UNL     1       1.442   2.863  -1.036  1.00  0.00           H  
HETATM   26  H   UNL     1       0.600   2.623   0.513  1.00  0.00           H  
HETATM   27  H   UNL     1       2.313   3.107   0.497  1.00  0.00           H  
HETATM   28  H   UNL     1       4.063   2.695   0.280  1.00  0.00           H  
HETATM   29  H   UNL     1       6.410   2.023   0.327  1.00  0.00           H  
HETATM   30  H   UNL     1       7.621  -0.651   0.928  1.00  0.00           H  
HETATM   31  H   UNL     1       5.302  -2.055  -0.337  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.767   1.380  -0.026  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.990  -1.675   0.030  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.369  -2.414   0.035  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.305  -2.470   1.055  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.961  -1.905  -0.500  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.638  -3.095  -0.473  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.199   0.595   0.849  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.149   3.050   0.957  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.299   3.303  -0.587  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.989   2.743  -0.582  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.489   1.787  -0.034  1.00  0.00           H  
CONECT    1    2   25   26   27                                       
CONECT    2    1   13   13    3                                       
CONECT    3    2    4    4    9                                       
CONECT    4    3    3    5   28                                       
CONECT    5    4    6    6   29                                       
CONECT    6    5    5    8    7                                       
CONECT    7    6   30                                                 
CONECT    8    9    9    6   31                                       
CONECT    9    3   10    8    8                                       
CONECT   10   11    9                                                 
CONECT   11   13   12   12   10                                       
CONECT   12   11   11                                                 
CONECT   13   14    2    2   11                                       
CONECT   14   15   15   13   32                                       
CONECT   15   16   14   14   33                                       
CONECT   16   17   17   24   15                                       
CONECT   17   18   16   16   34                                       
CONECT   18   19   20   20   17                                       
CONECT   19   18   35   36   37                                       
CONECT   20   21   18   18   22                                       
CONECT   21   20   38                                                 
CONECT   22   20   23   24   24                                       
CONECT   23   22   39   40   41                                       
CONECT   24   22   22   16   42                                       
CONECT   25    1                                                      
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32   14                                                      
CONECT   33   15                                                      
CONECT   34   17                                                      
CONECT   35   19                                                      
CONECT   36   19                                                      
CONECT   37   19                                                      
CONECT   38   21                                                      
CONECT   39   23                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
