COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.016   1.225   0.076  1.00  0.00           C  
HETATM    2  N   UNL     1       6.595   0.979  -0.203  1.00  0.00           N  
HETATM    3  C   UNL     1       5.842   2.239  -0.252  1.00  0.00           C  
HETATM    4  C   UNL     1       4.369   1.943  -0.543  1.00  0.00           C  
HETATM    5  O   UNL     1       3.807   1.208   0.545  1.00  0.00           O  
HETATM    6  C   UNL     1       2.497   0.862   0.444  1.00  0.00           C  
HETATM    7  C   UNL     1       1.771   1.219  -0.684  1.00  0.00           C  
HETATM    8  C   UNL     1       0.442   0.871  -0.790  1.00  0.00           C  
HETATM    9  C   UNL     1       1.888   0.147   1.468  1.00  0.00           C  
HETATM   10  C   UNL     1       0.559  -0.206   1.369  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.175   0.157   0.239  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.602  -0.219   0.129  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.643   0.832   0.101  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.513   0.984   1.182  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.482   1.964   1.152  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.594   2.799   0.048  1.00  0.00           C  
HETATM   17  O   UNL     1      -5.550   3.764   0.022  1.00  0.00           O  
HETATM   18  C   UNL     1      -3.730   2.651  -1.030  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.755   1.677  -1.005  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.955  -1.526   0.055  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.411  -1.914   0.060  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.904  -2.063  -1.381  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.917  -2.564  -0.031  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.077  -2.628  -1.148  1.00  0.00           C  
HETATM   25  C   UNL     1       0.894  -3.604  -1.221  1.00  0.00           C  
HETATM   26  C   UNL     1       1.039  -4.519  -0.193  1.00  0.00           C  
HETATM   27  C   UNL     1       0.212  -4.463   0.916  1.00  0.00           C  
HETATM   28  C   UNL     1      -0.761  -3.489   1.006  1.00  0.00           C  
HETATM   29  H   UNL     1       8.116   1.729   1.037  1.00  0.00           H  
HETATM   30  H   UNL     1       8.550   0.275   0.106  1.00  0.00           H  
HETATM   31  H   UNL     1       8.437   1.853  -0.709  1.00  0.00           H  
HETATM   32  H   UNL     1       6.479   0.455  -1.058  1.00  0.00           H  
HETATM   33  H   UNL     1       5.926   2.750   0.707  1.00  0.00           H  
HETATM   34  H   UNL     1       6.247   2.875  -1.039  1.00  0.00           H  
HETATM   35  H   UNL     1       3.828   2.880  -0.667  1.00  0.00           H  
HETATM   36  H   UNL     1       4.292   1.354  -1.458  1.00  0.00           H  
HETATM   37  H   UNL     1       2.249   1.772  -1.480  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.122   1.150  -1.668  1.00  0.00           H  
HETATM   39  H   UNL     1       2.457  -0.133   2.342  1.00  0.00           H  
HETATM   40  H   UNL     1       0.087  -0.762   2.165  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.427   0.335   2.040  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.156   2.082   1.987  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.263   4.612   0.388  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.820   3.302  -1.887  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.080   1.566  -1.841  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.532  -2.862   0.585  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.991  -1.142   0.565  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.931  -2.428  -1.377  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.865  -1.094  -1.880  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.268  -2.771  -1.912  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.189  -1.915  -1.952  1.00  0.00           H  
HETATM   52  H   UNL     1       1.543  -3.655  -2.083  1.00  0.00           H  
HETATM   53  H   UNL     1       1.801  -5.282  -0.256  1.00  0.00           H  
HETATM   54  H   UNL     1       0.331  -5.180   1.714  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.402  -3.444   1.874  1.00  0.00           H  
CONECT    1    2   29   30   31                                       
CONECT    2    1    3   32                                            
CONECT    3    2    4   33   34                                       
CONECT    4    3    5   35   36                                       
CONECT    5    4    6                                                 
CONECT    6    5    7    7    9                                       
CONECT    7    6    6    8   37                                       
CONECT    8    7   11   11   38                                       
CONECT    9    6   10   10   39                                       
CONECT   10    9    9   11   40                                       
CONECT   11    8    8   10   12                                       
CONECT   12   11   13   20   20                                       
CONECT   13   14   12   19   19                                       
CONECT   14   15   15   13   41                                       
CONECT   15   14   14   16   42                                       
CONECT   16   15   17   18   18                                       
CONECT   17   16   43                                                 
CONECT   18   16   16   19   44                                       
CONECT   19   13   13   18   45                                       
CONECT   20   12   12   23   21                                       
CONECT   21   20   22   46   47                                       
CONECT   22   21   48   49   50                                       
CONECT   23   24   20   28   28                                       
CONECT   24   25   25   23   51                                       
CONECT   25   24   24   26   52                                       
CONECT   26   25   27   27   53                                       
CONECT   27   26   26   28   54                                       
CONECT   28   23   23   27   55                                       
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   21                                                      
CONECT   47   21                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
