COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.157   0.479  -1.111  1.00  0.00           C  
HETATM    2  C   UNL     1       3.301   1.455  -0.303  1.00  0.00           C  
HETATM    3  C   UNL     1       1.934   1.616  -0.974  1.00  0.00           C  
HETATM    4  C   UNL     1       1.087   2.586  -0.147  1.00  0.00           C  
HETATM    5  C   UNL     1       1.674   2.700   1.261  1.00  0.00           C  
HETATM    6  O   UNL     1      -0.276   2.099  -0.064  1.00  0.00           O  
HETATM    7  C   UNL     1      -0.471   0.764  -0.064  1.00  0.00           C  
HETATM    8  O   UNL     1       0.474   0.000  -0.082  1.00  0.00           O  
HETATM    9  C   UNL     1      -1.849   0.250  -0.041  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.912   1.158   0.101  1.00  0.00           C  
HETATM   11  O   UNL     1      -2.656   2.481   0.260  1.00  0.00           O  
HETATM   12  C   UNL     1      -4.218   0.707   0.079  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.488  -0.646  -0.084  1.00  0.00           C  
HETATM   14  O   UNL     1      -5.774  -1.075  -0.130  1.00  0.00           O  
HETATM   15  C   UNL     1      -3.452  -1.560  -0.203  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.124  -1.126  -0.160  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.049  -2.133  -0.191  1.00  0.00           C  
HETATM   18  C   UNL     1       0.091  -1.948   0.457  1.00  0.00           C  
HETATM   19  C   UNL     1       1.164  -3.009   0.392  1.00  0.00           C  
HETATM   20  C   UNL     1       2.534  -2.377   0.630  1.00  0.00           C  
HETATM   21  C   UNL     1       3.008  -1.692  -0.653  1.00  0.00           C  
HETATM   22  C   UNL     1       4.253  -0.852  -0.359  1.00  0.00           C  
HETATM   23  O   UNL     1       4.338  -0.601   1.045  1.00  0.00           O  
HETATM   24  H   UNL     1       3.698   0.313  -2.086  1.00  0.00           H  
HETATM   25  H   UNL     1       5.156   0.894  -1.244  1.00  0.00           H  
HETATM   26  H   UNL     1       3.166   1.069   0.708  1.00  0.00           H  
HETATM   27  H   UNL     1       3.799   2.423  -0.258  1.00  0.00           H  
HETATM   28  H   UNL     1       2.067   2.013  -1.980  1.00  0.00           H  
HETATM   29  H   UNL     1       1.437   0.647  -1.026  1.00  0.00           H  
HETATM   30  H   UNL     1       1.093   3.567  -0.622  1.00  0.00           H  
HETATM   31  H   UNL     1       1.666   1.720   1.739  1.00  0.00           H  
HETATM   32  H   UNL     1       2.698   3.066   1.199  1.00  0.00           H  
HETATM   33  H   UNL     1       1.074   3.396   1.849  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.558   2.755   1.182  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.031   1.408   0.191  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.152  -1.092  -1.020  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.672  -2.610  -0.328  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.191  -3.043  -0.768  1.00  0.00           H  
HETATM   39  H   UNL     1       0.252  -1.061   1.053  1.00  0.00           H  
HETATM   40  H   UNL     1       0.975  -3.763   1.156  1.00  0.00           H  
HETATM   41  H   UNL     1       1.149  -3.479  -0.591  1.00  0.00           H  
HETATM   42  H   UNL     1       2.460  -1.640   1.430  1.00  0.00           H  
HETATM   43  H   UNL     1       3.247  -3.151   0.914  1.00  0.00           H  
HETATM   44  H   UNL     1       3.249  -2.448  -1.400  1.00  0.00           H  
HETATM   45  H   UNL     1       2.217  -1.046  -1.033  1.00  0.00           H  
HETATM   46  H   UNL     1       5.142  -1.391  -0.687  1.00  0.00           H  
HETATM   47  H   UNL     1       4.402  -1.401   1.584  1.00  0.00           H  
CONECT    1    2   22   24   25                                       
CONECT    2    3    1   26   27                                       
CONECT    3    4    2   28   29                                       
CONECT    4    5    6    3   30                                       
CONECT    5    4   31   32   33                                       
CONECT    6    7    4                                                 
CONECT    7    8    8    9    6                                       
CONECT    8    7    7                                                 
CONECT    9   10    7   16   16                                       
CONECT   10   11   12   12    9                                       
CONECT   11   10   34                                                 
CONECT   12   10   10   13   35                                       
CONECT   13   12   14   15   15                                       
CONECT   14   13   36                                                 
CONECT   15   13   13   16   37                                       
CONECT   16    9    9   15   17                                       
CONECT   17   16   18   18   38                                       
CONECT   18   17   17   19   39                                       
CONECT   19   18   20   40   41                                       
CONECT   20   19   21   42   43                                       
CONECT   21   22   20   44   45                                       
CONECT   22    1   21   23   46                                       
CONECT   23   22   47                                                 
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    2                                                      
CONECT   27    2                                                      
CONECT   28    3                                                      
CONECT   29    3                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
