COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.219   1.925  -0.800  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.385   2.114  -1.512  1.00  0.00           C  
HETATM    3  O   UNL     1      -6.614   2.358  -0.981  1.00  0.00           O  
HETATM    4  C   UNL     1      -7.415   2.463  -2.176  1.00  0.00           C  
HETATM    5  O   UNL     1      -6.656   2.281  -3.390  1.00  0.00           O  
HETATM    6  C   UNL     1      -5.409   2.071  -2.888  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.268   1.835  -3.627  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.073   1.641  -2.930  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.063   1.687  -1.533  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.760   1.474  -0.802  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.499   0.007  -0.466  1.00  0.00           C  
HETATM   12  N   UNL     1      -0.262  -0.185   0.257  1.00  0.00           N  
HETATM   13  C   UNL     1       0.949  -0.415  -0.367  1.00  0.00           C  
HETATM   14  O   UNL     1       1.144  -0.486  -1.575  1.00  0.00           O  
HETATM   15  C   UNL     1       2.099  -0.582   0.577  1.00  0.00           C  
HETATM   16  C   UNL     1       2.302  -2.062   0.910  1.00  0.00           C  
HETATM   17  C   UNL     1       3.240  -2.549  -0.184  1.00  0.00           C  
HETATM   18  C   UNL     1       4.168  -1.358  -0.409  1.00  0.00           C  
HETATM   19  N   UNL     1       3.344  -0.193  -0.086  1.00  0.00           N  
HETATM   20  C   UNL     1       3.773   1.109  -0.254  1.00  0.00           C  
HETATM   21  N   UNL     1       2.955   2.167   0.066  1.00  0.00           N  
HETATM   22  C   UNL     1       5.062   1.348  -0.759  1.00  0.00           C  
HETATM   23  C   UNL     1       5.454   2.662  -0.913  1.00  0.00           C  
HETATM   24  C   UNL     1       6.815   2.965  -1.445  1.00  0.00           C  
HETATM   25  N   UNL     1       4.672   3.718  -0.608  1.00  0.00           N  
HETATM   26  C   UNL     1       3.453   3.403  -0.130  1.00  0.00           C  
HETATM   27  N   UNL     1       2.621   4.466   0.196  1.00  0.00           N  
HETATM   28  C   UNL     1       1.350   4.379   0.694  1.00  0.00           C  
HETATM   29  C   UNL     1       0.941   5.682   0.854  1.00  0.00           C  
HETATM   30  N   UNL     1       1.924   6.560   0.469  1.00  0.00           N  
HETATM   31  C   UNL     1       2.921   5.797   0.079  1.00  0.00           C  
HETATM   32  H   UNL     1      -4.213   1.962   0.284  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.881   3.454  -2.200  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.204   1.703  -2.139  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.291   1.801  -4.710  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.158   1.453  -3.486  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.780   2.060   0.125  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.931   1.878  -1.396  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.301  -0.377   0.173  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.455  -0.612  -1.368  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.285  -0.149   1.271  1.00  0.00           H  
HETATM   42  H   UNL     1       1.904   0.005   1.480  1.00  0.00           H  
HETATM   43  H   UNL     1       1.371  -2.637   0.942  1.00  0.00           H  
HETATM   44  H   UNL     1       2.798  -2.157   1.884  1.00  0.00           H  
HETATM   45  H   UNL     1       3.785  -3.455   0.095  1.00  0.00           H  
HETATM   46  H   UNL     1       2.673  -2.761  -1.099  1.00  0.00           H  
HETATM   47  H   UNL     1       5.025  -1.405   0.271  1.00  0.00           H  
HETATM   48  H   UNL     1       4.533  -1.328  -1.441  1.00  0.00           H  
HETATM   49  H   UNL     1       5.715   0.521  -1.013  1.00  0.00           H  
HETATM   50  H   UNL     1       7.205   3.884  -0.992  1.00  0.00           H  
HETATM   51  H   UNL     1       7.516   2.147  -1.234  1.00  0.00           H  
HETATM   52  H   UNL     1       6.796   3.094  -2.535  1.00  0.00           H  
HETATM   53  H   UNL     1       0.860   3.434   0.887  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.010   6.033   1.226  1.00  0.00           H  
HETATM   55  H   UNL     1       3.873   6.150  -0.295  1.00  0.00           H  
CONECT    1    9    9    2   32                                       
CONECT    2    1    3    6    6                                       
CONECT    3    2    4                                                 
CONECT    4    3    5   33   34                                       
CONECT    5    4    6                                                 
CONECT    6    2    2    5    7                                       
CONECT    7    6    8    8   35                                       
CONECT    8    7    7    9   36                                       
CONECT    9    1    1    8   10                                       
CONECT   10    9   11   37   38                                       
CONECT   11   10   12   39   40                                       
CONECT   12   11   13   41                                            
CONECT   13   12   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15   13   16   19   42                                       
CONECT   16   15   17   43   44                                       
CONECT   17   16   18   45   46                                       
CONECT   18   17   19   47   48                                       
CONECT   19   15   18   20                                            
CONECT   20   19   22   21   21                                       
CONECT   21   20   20   26                                            
CONECT   22   20   23   23   49                                       
CONECT   23   22   22   24   25                                       
CONECT   24   23   50   51   52                                       
CONECT   25   23   26   26                                            
CONECT   26   21   25   25   27                                       
CONECT   27   26   28   31                                            
CONECT   28   27   29   29   53                                       
CONECT   29   28   28   30   54                                       
CONECT   30   29   31   31                                            
CONECT   31   27   30   30   55                                       
CONECT   32    1                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37   10                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   18                                                      
CONECT   49   22                                                      
CONECT   50   24                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
CONECT   55   31                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
