COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       7.269  -2.609  -0.382  1.00  0.00           O  
HETATM    2  C   UNL     1       6.359  -1.611  -0.241  1.00  0.00           C  
HETATM    3  C   UNL     1       5.001  -1.900  -0.270  1.00  0.00           C  
HETATM    4  C   UNL     1       6.786  -0.302  -0.060  1.00  0.00           C  
HETATM    5  C   UNL     1       5.865   0.713   0.083  1.00  0.00           C  
HETATM    6  C   UNL     1       4.499   0.428   0.049  1.00  0.00           C  
HETATM    7  C   UNL     1       3.314   1.315   0.176  1.00  0.00           C  
HETATM    8  N   UNL     1       2.958   2.574   0.352  1.00  0.00           N  
HETATM    9  N   UNL     1       1.559   2.642   0.366  1.00  0.00           N  
HETATM   10  C   UNL     1       4.077  -0.887  -0.127  1.00  0.00           C  
HETATM   11  C   UNL     1       2.568  -0.891  -0.123  1.00  0.00           C  
HETATM   12  C   UNL     1       2.146   0.544   0.073  1.00  0.00           C  
HETATM   13  C   UNL     1       1.075   1.379   0.193  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.350   0.987   0.143  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.793  -0.128   0.858  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.120  -0.492   0.811  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.254   1.735  -0.614  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.581   1.369  -0.660  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.022   0.252   0.049  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.450  -0.142  -0.001  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.353   0.600  -0.762  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.681   0.232  -0.808  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.893  -1.258   0.707  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.222  -1.622   0.657  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.119  -0.878  -0.097  1.00  0.00           C  
HETATM   26  O   UNL     1      -8.428  -1.238  -0.143  1.00  0.00           O  
HETATM   27  H   UNL     1       7.527  -2.780  -1.298  1.00  0.00           H  
HETATM   28  H   UNL     1       4.669  -2.918  -0.406  1.00  0.00           H  
HETATM   29  H   UNL     1       7.842  -0.079  -0.033  1.00  0.00           H  
HETATM   30  H   UNL     1       6.201   1.730   0.223  1.00  0.00           H  
HETATM   31  H   UNL     1       1.028   3.446   0.480  1.00  0.00           H  
HETATM   32  H   UNL     1       2.192  -1.267  -1.074  1.00  0.00           H  
HETATM   33  H   UNL     1       2.197  -1.506   0.696  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.095  -0.704   1.447  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.463  -1.354   1.364  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.913   2.600  -1.163  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.280   1.947  -1.245  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.012   1.464  -1.315  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.380   0.806  -1.396  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.195  -1.838   1.293  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.565  -2.487   1.206  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.641  -1.856  -0.856  1.00  0.00           H  
CONECT    1    2   27                                                 
CONECT    2    4    1    3    3                                       
CONECT    3    2    2   10   28                                       
CONECT    4    5    5    2   29                                       
CONECT    5    4    4    6   30                                       
CONECT    6    5    7   10   10                                       
CONECT    7    8    8    6   12                                       
CONECT    8    9    7    7                                            
CONECT    9    8   13   31                                            
CONECT   10    6    6   11    3                                       
CONECT   11   12   10   32   33                                       
CONECT   12    7   13   13   11                                       
CONECT   13    9   12   12   14                                       
CONECT   14   13   15   15   17                                       
CONECT   15   14   14   16   34                                       
CONECT   16   15   19   19   35                                       
CONECT   17   14   18   18   36                                       
CONECT   18   17   17   19   37                                       
CONECT   19   16   16   18   20                                       
CONECT   20   19   21   21   23                                       
CONECT   21   20   20   22   38                                       
CONECT   22   21   25   25   39                                       
CONECT   23   20   24   24   40                                       
CONECT   24   23   23   25   41                                       
CONECT   25   22   22   24   26                                       
CONECT   26   25   42                                                 
CONECT   27    1                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    9                                                      
CONECT   32   11                                                      
CONECT   33   11                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   18                                                      
CONECT   38   21                                                      
CONECT   39   22                                                      
CONECT   40   23                                                      
CONECT   41   24                                                      
CONECT   42   26                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
