COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.024  -1.397   0.947  1.00  0.00           C  
HETATM    2  C   UNL     1       4.402  -1.867  -0.371  1.00  0.00           C  
HETATM    3  C   UNL     1       2.546  -0.331  -0.242  1.00  0.00           C  
HETATM    4  C   UNL     1       3.331   0.407   0.800  1.00  0.00           C  
HETATM    5  C   UNL     1       4.443  -0.065   1.333  1.00  0.00           C  
HETATM    6  C   UNL     1       2.841   1.717   1.251  1.00  0.00           C  
HETATM    7  C   UNL     1       2.272  -2.458  -1.365  1.00  0.00           C  
HETATM    8  C   UNL     1       0.812  -2.720  -0.991  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.968  -0.533  -0.339  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.314  -0.639   0.270  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.190   0.446   0.225  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.445   0.340   0.788  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.835  -0.840   1.397  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.971  -1.919   1.445  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.714  -1.825   0.885  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.461   0.783  -0.793  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.715   1.929  -0.039  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.240   3.152  -0.467  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.515   3.243  -1.641  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.260   2.110  -2.393  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.724   0.880  -1.972  1.00  0.00           C  
HETATM   22  N   UNL     1       2.938  -1.746  -0.267  1.00  0.00           N  
HETATM   23  N   UNL     1      -1.229  -1.597  -0.474  1.00  0.00           N  
HETATM   24  O   UNL     1       1.709   2.230   0.728  1.00  0.00           O  
HETATM   25  O   UNL     1       3.456   2.339   2.095  1.00  0.00           O  
HETATM   26  O   UNL     1       0.106  -1.479  -0.931  1.00  0.00           O  
HETATM   27  H   UNL     1       4.812  -2.126   1.729  1.00  0.00           H  
HETATM   28  H   UNL     1       6.103  -1.300   0.824  1.00  0.00           H  
HETATM   29  H   UNL     1       4.764  -1.245  -1.189  1.00  0.00           H  
HETATM   30  H   UNL     1       4.674  -2.907  -0.553  1.00  0.00           H  
HETATM   31  H   UNL     1       1.483  -0.256  -0.014  1.00  0.00           H  
HETATM   32  H   UNL     1       2.736   0.113  -1.219  1.00  0.00           H  
HETATM   33  H   UNL     1       4.955   0.528   2.076  1.00  0.00           H  
HETATM   34  H   UNL     1       2.777  -3.408  -1.542  1.00  0.00           H  
HETATM   35  H   UNL     1       2.312  -1.851  -2.270  1.00  0.00           H  
HETATM   36  H   UNL     1       0.353  -3.362  -1.743  1.00  0.00           H  
HETATM   37  H   UNL     1       0.768  -3.210  -0.019  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.886   1.367  -0.250  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.124   1.179   0.754  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.819  -0.918   1.837  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.281  -2.837   1.922  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.042  -2.670   0.919  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.282   1.859   0.877  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.436   4.040   0.116  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.146   4.202  -1.973  1.00  0.00           H  
HETATM   46  H   UNL     1       0.307   2.187  -3.309  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.520  -0.004  -2.557  1.00  0.00           H  
HETATM   48  H   UNL     1       1.426   3.094   1.055  1.00  0.00           H  
CONECT    1    2    5   27   28                                       
CONECT    2   22    1   29   30                                       
CONECT    3   22    4   31   32                                       
CONECT    4    3    6    5    5                                       
CONECT    5    4    4    1   33                                       
CONECT    6   25   25    4   24                                       
CONECT    7    8   22   34   35                                       
CONECT    8    7   26   36   37                                       
CONECT    9   10   23   23   16                                       
CONECT   10   11   11   15    9                                       
CONECT   11   12   10   10   38                                       
CONECT   12   13   13   11   39                                       
CONECT   13   12   12   14   40                                       
CONECT   14   13   15   15   41                                       
CONECT   15   14   14   10   42                                       
CONECT   16    9   17   17   21                                       
CONECT   17   16   16   18   43                                       
CONECT   18   17   19   19   44                                       
CONECT   19   18   18   20   45                                       
CONECT   20   21   21   19   46                                       
CONECT   21   16   20   20   47                                       
CONECT   22    7    3    2                                            
CONECT   23   26    9    9                                            
CONECT   24    6   48                                                 
CONECT   25    6    6                                                 
CONECT   26    8   23                                                 
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   24                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
