COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.027   1.568   1.470  1.00  0.00           C  
HETATM    2  C   UNL     1       5.131   0.347   0.592  1.00  0.00           C  
HETATM    3  C   UNL     1       6.358  -0.249   0.380  1.00  0.00           C  
HETATM    4  C   UNL     1       6.454  -1.369  -0.425  1.00  0.00           C  
HETATM    5  C   UNL     1       5.323  -1.895  -1.021  1.00  0.00           C  
HETATM    6  C   UNL     1       4.092  -1.303  -0.813  1.00  0.00           C  
HETATM    7  C   UNL     1       3.991  -0.182   0.000  1.00  0.00           C  
HETATM    8  N   UNL     1       2.746   0.417   0.217  1.00  0.00           N  
HETATM    9  C   UNL     1       1.617  -0.309   0.090  1.00  0.00           C  
HETATM   10  O   UNL     1       1.684  -1.503  -0.113  1.00  0.00           O  
HETATM   11  C   UNL     1       0.273   0.362   0.202  1.00  0.00           C  
HETATM   12  C   UNL     1       0.146   1.434  -0.883  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.145   2.187  -0.696  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.177   3.318   0.099  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.362   4.009   0.270  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.514   3.570  -0.354  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.482   2.441  -1.150  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.297   1.752  -1.325  1.00  0.00           C  
HETATM   19  N   UNL     1      -0.786  -0.635   0.029  1.00  0.00           N  
HETATM   20  C   UNL     1      -2.006  -0.423   0.562  1.00  0.00           C  
HETATM   21  O   UNL     1      -2.227   0.596   1.187  1.00  0.00           O  
HETATM   22  C   UNL     1      -3.075  -1.429   0.388  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.338  -1.212   0.939  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.332  -2.155   0.772  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.077  -3.314   0.061  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.826  -3.535  -0.488  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.826  -2.598  -0.334  1.00  0.00           C  
HETATM   28  H   UNL     1       5.154   2.464   0.863  1.00  0.00           H  
HETATM   29  H   UNL     1       4.048   1.589   1.949  1.00  0.00           H  
HETATM   30  H   UNL     1       5.805   1.533   2.234  1.00  0.00           H  
HETATM   31  H   UNL     1       7.244   0.159   0.844  1.00  0.00           H  
HETATM   32  H   UNL     1       7.415  -1.834  -0.590  1.00  0.00           H  
HETATM   33  H   UNL     1       5.401  -2.770  -1.650  1.00  0.00           H  
HETATM   34  H   UNL     1       3.209  -1.714  -1.279  1.00  0.00           H  
HETATM   35  H   UNL     1       2.694   1.355   0.459  1.00  0.00           H  
HETATM   36  H   UNL     1       0.178   0.826   1.184  1.00  0.00           H  
HETATM   37  H   UNL     1       0.985   2.126  -0.809  1.00  0.00           H  
HETATM   38  H   UNL     1       0.152   0.960  -1.865  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.276   3.660   0.587  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.387   4.892   0.892  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.440   4.110  -0.220  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.383   2.098  -1.638  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.271   0.871  -1.950  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.610  -1.448  -0.470  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.538  -0.308   1.495  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.310  -1.988   1.198  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.858  -4.049  -0.067  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.634  -4.442  -1.043  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.850  -2.771  -0.763  1.00  0.00           H  
CONECT    1    2   28   29   30                                       
CONECT    2    1    3    3    7                                       
CONECT    3    2    2    4   31                                       
CONECT    4    3    5    5   32                                       
CONECT    5    4    4    6   33                                       
CONECT    6    7    7    5   34                                       
CONECT    7    2    8    6    6                                       
CONECT    8    9    7   35                                            
CONECT    9   10   10   11    8                                       
CONECT   10    9    9                                                 
CONECT   11   19   12    9   36                                       
CONECT   12   11   13   37   38                                       
CONECT   13   12   14   14   18                                       
CONECT   14   13   13   15   39                                       
CONECT   15   14   16   16   40                                       
CONECT   16   15   15   17   41                                       
CONECT   17   18   18   16   42                                       
CONECT   18   13   17   17   43                                       
CONECT   19   20   11   44                                            
CONECT   20   22   19   21   21                                       
CONECT   21   20   20                                                 
CONECT   22   23   23   27   20                                       
CONECT   23   24   22   22   45                                       
CONECT   24   25   25   23   46                                       
CONECT   25   24   24   26   47                                       
CONECT   26   25   27   27   48                                       
CONECT   27   26   26   22   49                                       
CONECT   28    1                                                      
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
