COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.859   3.405   1.122  1.00  0.00           C  
HETATM    2  O   UNL     1       3.847   2.487   0.703  1.00  0.00           O  
HETATM    3  C   UNL     1       4.264   1.302   0.192  1.00  0.00           C  
HETATM    4  C   UNL     1       5.620   1.024   0.093  1.00  0.00           C  
HETATM    5  C   UNL     1       6.043  -0.182  -0.427  1.00  0.00           C  
HETATM    6  C   UNL     1       5.120  -1.123  -0.855  1.00  0.00           C  
HETATM    7  C   UNL     1       3.770  -0.864  -0.765  1.00  0.00           C  
HETATM    8  C   UNL     1       3.328   0.350  -0.234  1.00  0.00           C  
HETATM    9  C   UNL     1       1.883   0.632  -0.128  1.00  0.00           C  
HETATM   10  O   UNL     1       1.503   1.692   0.329  1.00  0.00           O  
HETATM   11  N   UNL     1       0.986  -0.286  -0.539  1.00  0.00           N  
HETATM   12  C   UNL     1      -0.385  -0.059  -0.352  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.893   1.227  -0.447  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.249   1.450  -0.262  1.00  0.00           C  
HETATM   15  N   UNL     1      -3.040   2.599  -0.293  1.00  0.00           N  
HETATM   16  C   UNL     1      -2.566   3.960  -0.555  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.314   2.243  -0.041  1.00  0.00           C  
HETATM   18  O   UNL     1      -5.259   3.007   0.004  1.00  0.00           O  
HETATM   19  N   UNL     1      -4.383   0.912   0.151  1.00  0.00           N  
HETATM   20  C   UNL     1      -5.600   0.151   0.448  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.101   0.381   0.019  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.592  -0.906   0.114  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.238  -1.128  -0.077  1.00  0.00           C  
HETATM   24  N   UNL     1      -0.723  -2.428   0.013  1.00  0.00           N  
HETATM   25  C   UNL     1      -1.342  -3.310  -0.985  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.656  -4.677  -0.957  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.795  -5.283   0.442  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.185  -4.324   1.468  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.885  -2.967   1.369  1.00  0.00           C  
HETATM   30  H   UNL     1       5.493   3.660   0.272  1.00  0.00           H  
HETATM   31  H   UNL     1       4.391   4.310   1.510  1.00  0.00           H  
HETATM   32  H   UNL     1       5.465   2.947   1.903  1.00  0.00           H  
HETATM   33  H   UNL     1       6.345   1.753   0.424  1.00  0.00           H  
HETATM   34  H   UNL     1       7.099  -0.394  -0.502  1.00  0.00           H  
HETATM   35  H   UNL     1       5.461  -2.065  -1.261  1.00  0.00           H  
HETATM   36  H   UNL     1       3.054  -1.600  -1.099  1.00  0.00           H  
HETATM   37  H   UNL     1       1.289  -1.104  -0.964  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.233   2.055  -0.665  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.610   4.161  -1.625  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.199   4.673  -0.026  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.538   4.060  -0.207  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.451   0.830   0.491  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.765  -0.589  -0.335  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.488  -0.353   1.408  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.251  -1.733   0.331  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.401  -3.430  -0.757  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.233  -2.869  -1.977  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.444  -2.277   2.089  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.946  -3.088   1.587  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.126  -5.336  -1.687  1.00  0.00           H  
HETATM   51  H   UNL     1       0.400  -4.559  -1.199  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.849  -5.437   0.670  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.270  -6.238   0.480  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.319  -4.730   2.471  1.00  0.00           H  
HETATM   55  H   UNL     1       0.878  -4.200   1.264  1.00  0.00           H  
CONECT    1    2   30   31   32                                       
CONECT    2    1    3                                                 
CONECT    3    2    4    8    8                                       
CONECT    4    3    5    5   33                                       
CONECT    5    4    4    6   34                                       
CONECT    6    5    7    7   35                                       
CONECT    7    6    6    8   36                                       
CONECT    8    3    3    7    9                                       
CONECT    9    8   10   10   11                                       
CONECT   10    9    9                                                 
CONECT   11    9   12   37                                            
CONECT   12   11   13   23   23                                       
CONECT   13   12   14   14   38                                       
CONECT   14   13   13   15   21                                       
CONECT   15   14   16   17                                            
CONECT   16   15   39   40   41                                       
CONECT   17   15   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20   21                                            
CONECT   20   19   42   43   44                                       
CONECT   21   14   19   22   22                                       
CONECT   22   21   21   23   45                                       
CONECT   23   12   12   22   24                                       
CONECT   24   23   25   29                                            
CONECT   25   24   26   46   47                                       
CONECT   26   25   27   50   51                                       
CONECT   27   26   28   52   53                                       
CONECT   28   27   29   54   55                                       
CONECT   29   24   28   48   49                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37   11                                                      
CONECT   38   13                                                      
CONECT   39   16                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   22                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   29                                                      
CONECT   49   29                                                      
CONECT   50   26                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
CONECT   54   28                                                      
CONECT   55   28                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
