COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.484  -1.789  -0.692  1.00  0.00           O  
HETATM    2  C   UNL     1      -0.800  -1.133   0.282  1.00  0.00           C  
HETATM    3  O   UNL     1      -1.060  -1.748   1.454  1.00  0.00           O  
HETATM    4  C   UNL     1      -0.943  -3.195   1.479  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.273  -3.709   2.882  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.893   0.327   0.184  1.00  0.00           C  
HETATM    7  C   UNL     1       0.183   1.308   0.423  1.00  0.00           C  
HETATM    8  C   UNL     1       1.522   1.204   0.787  1.00  0.00           C  
HETATM    9  C   UNL     1       2.281   2.351   0.933  1.00  0.00           C  
HETATM   10  O   UNL     1       3.590   2.259   1.289  1.00  0.00           O  
HETATM   11  C   UNL     1       1.707   3.599   0.717  1.00  0.00           C  
HETATM   12  C   UNL     1       0.381   3.709   0.356  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.397   2.567   0.205  1.00  0.00           C  
HETATM   14  O   UNL     1      -1.691   2.380  -0.132  1.00  0.00           O  
HETATM   15  C   UNL     1      -2.008   1.076  -0.158  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.335   0.526  -0.494  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.387   1.385  -0.825  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.625   0.864  -1.138  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.827  -0.505  -1.125  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.790  -1.361  -0.799  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.545  -0.855  -0.489  1.00  0.00           C  
HETATM   22  C   UNL     1       2.141  -0.149   1.021  1.00  0.00           C  
HETATM   23  N   UNL     1       2.700  -0.657  -0.239  1.00  0.00           N  
HETATM   24  C   UNL     1       3.099  -2.066  -0.108  1.00  0.00           C  
HETATM   25  C   UNL     1       3.619  -2.570  -1.457  1.00  0.00           C  
HETATM   26  O   UNL     1       4.701  -1.738  -1.886  1.00  0.00           O  
HETATM   27  C   UNL     1       4.347  -0.359  -2.024  1.00  0.00           C  
HETATM   28  C   UNL     1       3.834   0.167  -0.681  1.00  0.00           C  
HETATM   29  H   UNL     1      -1.638  -3.628   0.761  1.00  0.00           H  
HETATM   30  H   UNL     1       0.076  -3.481   1.217  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.184  -4.795   2.901  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.577  -3.276   3.601  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.291  -3.423   3.144  1.00  0.00           H  
HETATM   34  H   UNL     1       4.197   2.189   0.539  1.00  0.00           H  
HETATM   35  H   UNL     1       2.305   4.491   0.832  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.054   4.683   0.190  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.231   2.453  -0.835  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.439   1.526  -1.394  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.798  -0.907  -1.371  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.954  -2.428  -0.791  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.736  -1.524  -0.235  1.00  0.00           H  
HETATM   42  H   UNL     1       2.935  -0.062   1.763  1.00  0.00           H  
HETATM   43  H   UNL     1       1.379  -0.839   1.385  1.00  0.00           H  
HETATM   44  H   UNL     1       3.886  -2.153   0.641  1.00  0.00           H  
HETATM   45  H   UNL     1       2.238  -2.661   0.195  1.00  0.00           H  
HETATM   46  H   UNL     1       3.970  -3.596  -1.352  1.00  0.00           H  
HETATM   47  H   UNL     1       2.817  -2.533  -2.194  1.00  0.00           H  
HETATM   48  H   UNL     1       5.223   0.213  -2.329  1.00  0.00           H  
HETATM   49  H   UNL     1       3.566  -0.257  -2.778  1.00  0.00           H  
HETATM   50  H   UNL     1       3.510   1.202  -0.796  1.00  0.00           H  
HETATM   51  H   UNL     1       4.633   0.115   0.059  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1    6                                       
CONECT    3    4    2                                                 
CONECT    4    5    3   29   30                                       
CONECT    5    4   31   32   33                                       
CONECT    6    2   15   15    7                                       
CONECT    7    6    8    8   13                                       
CONECT    8   22    7    7    9                                       
CONECT    9    8   10   11   11                                       
CONECT   10    9   34                                                 
CONECT   11    9    9   12   35                                       
CONECT   12   13   13   11   36                                       
CONECT   13    7   14   12   12                                       
CONECT   14   15   13                                                 
CONECT   15    6    6   16   14                                       
CONECT   16   21   21   17   15                                       
CONECT   17   18   18   16   37                                       
CONECT   18   19   17   17   38                                       
CONECT   19   20   20   18   39                                       
CONECT   20   19   19   21   40                                       
CONECT   21   20   16   16   41                                       
CONECT   22    8   23   42   43                                       
CONECT   23   22   28   24                                            
CONECT   24   23   25   44   45                                       
CONECT   25   24   26   46   47                                       
CONECT   26   27   25                                                 
CONECT   27   28   26   48   49                                       
CONECT   28   27   23   50   51                                       
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   17                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   21                                                      
CONECT   42   22                                                      
CONECT   43   22                                                      
CONECT   44   24                                                      
CONECT   45   24                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   27                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
