COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.306  -0.234  -1.031  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.414   0.310  -1.648  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.538   1.683  -1.768  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.553   2.517  -1.271  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.440   1.984  -0.653  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.311   0.602  -0.529  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.117   0.023   0.135  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.122   0.859   0.637  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.990  -1.358   0.264  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.874  -1.893   0.885  1.00  0.00           C  
HETATM   11  O   UNL     1      -1.747  -3.240   1.012  1.00  0.00           O  
HETATM   12  C   UNL     1      -2.803  -4.044   0.483  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.884  -1.053   1.377  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.012   0.318   1.255  1.00  0.00           C  
HETATM   15  C   UNL     1       0.063   1.224   1.797  1.00  0.00           C  
HETATM   16  C   UNL     1       0.209   0.998   3.303  1.00  0.00           C  
HETATM   17  C   UNL     1       1.340   0.923   1.130  1.00  0.00           C  
HETATM   18  C   UNL     1       2.359   0.683   0.598  1.00  0.00           C  
HETATM   19  C   UNL     1       3.602   0.391  -0.051  1.00  0.00           C  
HETATM   20  C   UNL     1       4.762   1.094   0.273  1.00  0.00           C  
HETATM   21  C   UNL     1       4.730   2.181   1.317  1.00  0.00           C  
HETATM   22  N   UNL     1       5.891   0.794  -0.348  1.00  0.00           N  
HETATM   23  C   UNL     1       5.934  -0.159  -1.268  1.00  0.00           C  
HETATM   24  N   UNL     1       7.137  -0.437  -1.890  1.00  0.00           N  
HETATM   25  N   UNL     1       4.858  -0.854  -1.609  1.00  0.00           N  
HETATM   26  C   UNL     1       3.687  -0.620  -1.030  1.00  0.00           C  
HETATM   27  N   UNL     1       2.568  -1.351  -1.385  1.00  0.00           N  
HETATM   28  H   UNL     1      -5.212  -1.305  -0.934  1.00  0.00           H  
HETATM   29  H   UNL     1      -7.186  -0.337  -2.038  1.00  0.00           H  
HETATM   30  H   UNL     1      -7.406   2.104  -2.252  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.654   3.588  -1.368  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.672   2.636  -0.266  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.219   1.931   0.543  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.761  -2.011  -0.119  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.739  -3.790   0.981  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.899  -3.859  -0.587  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.577  -5.097   0.650  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.014  -1.472   1.861  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.209   2.263   1.610  1.00  0.00           H  
HETATM   40  H   UNL     1       0.987   1.654   3.695  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.737   1.221   3.797  1.00  0.00           H  
HETATM   42  H   UNL     1       0.481  -0.041   3.490  1.00  0.00           H  
HETATM   43  H   UNL     1       4.939   1.750   2.296  1.00  0.00           H  
HETATM   44  H   UNL     1       5.484   2.933   1.082  1.00  0.00           H  
HETATM   45  H   UNL     1       3.744   2.646   1.327  1.00  0.00           H  
HETATM   46  H   UNL     1       7.933   0.062  -1.651  1.00  0.00           H  
HETATM   47  H   UNL     1       7.185  -1.132  -2.565  1.00  0.00           H  
HETATM   48  H   UNL     1       1.715  -1.171  -0.959  1.00  0.00           H  
HETATM   49  H   UNL     1       2.636  -2.045  -2.059  1.00  0.00           H  
CONECT    1    2    2    6   28                                       
CONECT    2    1    1    3   29                                       
CONECT    3    2    4    4   30                                       
CONECT    4    3    3    5   31                                       
CONECT    5    4    6    6   32                                       
CONECT    6    1    5    5    7                                       
CONECT    7    6    8    8    9                                       
CONECT    8    7    7   14   33                                       
CONECT    9    7   10   10   34                                       
CONECT   10    9    9   11   13                                       
CONECT   11   10   12                                                 
CONECT   12   11   35   36   37                                       
CONECT   13   10   14   14   38                                       
CONECT   14    8   13   13   15                                       
CONECT   15   14   16   17   39                                       
CONECT   16   15   40   41   42                                       
CONECT   17   15   18   18   18                                       
CONECT   18   17   17   17   19                                       
CONECT   19   18   20   20   26                                       
CONECT   20   19   19   21   22                                       
CONECT   21   20   43   44   45                                       
CONECT   22   20   23   23                                            
CONECT   23   22   22   24   25                                       
CONECT   24   23   46   47                                            
CONECT   25   23   26   26                                            
CONECT   26   19   25   25   27                                       
CONECT   27   26   48   49                                            
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   21                                                      
CONECT   44   21                                                      
CONECT   45   21                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48   27                                                      
CONECT   49   27                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
