COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.284   2.024  -0.594  1.00  0.00           C  
HETATM    2  C   UNL     1       3.393  -0.904  -0.608  1.00  0.00           C  
HETATM    3  C   UNL     1       2.234  -0.151   0.047  1.00  0.00           C  
HETATM    4  C   UNL     1       0.981  -0.985  -0.037  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.321  -2.631   0.320  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.491  -3.360   0.162  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.701  -2.722  -0.005  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.353  -1.249   0.318  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.581  -0.583   0.155  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.761  -1.331  -0.016  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.291   0.846  -0.072  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.945   0.782   0.108  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.080   2.082  -0.171  1.00  0.00           C  
HETATM   14  C   UNL     1       2.567   0.121   1.516  1.00  0.00           C  
HETATM   15  C   UNL     1       3.839   0.968   1.602  1.00  0.00           C  
HETATM   16  C   UNL     1       4.998   0.215   0.946  1.00  0.00           C  
HETATM   17  C   UNL     1       4.665  -0.057  -0.522  1.00  0.00           C  
HETATM   18  C   UNL     1       2.012   1.177  -0.680  1.00  0.00           C  
HETATM   19  C   UNL     1       3.617   2.296   0.874  1.00  0.00           C  
HETATM   20  C   UNL     1       4.443   1.271  -1.249  1.00  0.00           C  
HETATM   21  N   UNL     1      -0.174  -0.520   0.479  1.00  0.00           N  
HETATM   22  O   UNL     1       1.013  -2.074  -0.569  1.00  0.00           O  
HETATM   23  N   UNL     1       5.778  -0.780  -1.151  1.00  0.00           N  
HETATM   24  N   UNL     1      -4.798  -0.438  -0.151  1.00  0.00           N  
HETATM   25  N   UNL     1      -6.414   2.017  -0.354  1.00  0.00           N  
HETATM   26  O   UNL     1      -4.529   3.164  -0.089  1.00  0.00           O  
HETATM   27  H   UNL     1       3.126   2.970  -1.112  1.00  0.00           H  
HETATM   28  H   UNL     1       3.551  -1.850  -0.090  1.00  0.00           H  
HETATM   29  H   UNL     1       3.156  -1.098  -1.654  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.381  -3.147   0.450  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.453  -4.439   0.169  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.604  -3.301  -0.127  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.275   1.624   0.206  1.00  0.00           H  
HETATM   34  H   UNL     1       1.741   0.658   1.983  1.00  0.00           H  
HETATM   35  H   UNL     1       2.725  -0.825   2.034  1.00  0.00           H  
HETATM   36  H   UNL     1       4.076   1.162   2.648  1.00  0.00           H  
HETATM   37  H   UNL     1       5.904   0.818   1.008  1.00  0.00           H  
HETATM   38  H   UNL     1       5.156  -0.731   1.464  1.00  0.00           H  
HETATM   39  H   UNL     1       1.186   1.714  -0.213  1.00  0.00           H  
HETATM   40  H   UNL     1       1.775   0.983  -1.726  1.00  0.00           H  
HETATM   41  H   UNL     1       4.523   2.899   0.936  1.00  0.00           H  
HETATM   42  H   UNL     1       2.791   2.832   1.341  1.00  0.00           H  
HETATM   43  H   UNL     1       4.206   1.077  -2.295  1.00  0.00           H  
HETATM   44  H   UNL     1       5.349   1.874  -1.188  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.186   0.322   0.961  1.00  0.00           H  
HETATM   46  H   UNL     1       6.630  -0.241  -1.107  1.00  0.00           H  
HETATM   47  H   UNL     1       5.903  -1.689  -0.730  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.731  -0.670  -0.279  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.853   1.155  -0.420  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.935   2.833  -0.420  1.00  0.00           H  
CONECT    1   20   19   18   27                                       
CONECT    2   17    3   28   29                                       
CONECT    3    2   14    4   18                                       
CONECT    4   21    3   22   22                                       
CONECT    5    8    6    6   30                                       
CONECT    6    5    5    7   31                                       
CONECT    7   10   10    6   32                                       
CONECT    8   21    9    9    5                                       
CONECT    9   12    8    8   10                                       
CONECT   10    9   24    7    7                                       
CONECT   11   13   12   12   24                                       
CONECT   12   11   11    9   33                                       
CONECT   13   25   11   26   26                                       
CONECT   14   15    3   34   35                                       
CONECT   15   16   14   19   36                                       
CONECT   16   17   15   37   38                                       
CONECT   17   23   16    2   20                                       
CONECT   18    3    1   39   40                                       
CONECT   19   15    1   41   42                                       
CONECT   20   17    1   43   44                                       
CONECT   21    8    4   45                                            
CONECT   22    4    4                                                 
CONECT   23   17   46   47                                            
CONECT   24   11   10   48                                            
CONECT   25   13   49   50                                            
CONECT   26   13   13                                                 
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    2                                                      
CONECT   30    5                                                      
CONECT   31    6                                                      
CONECT   32    7                                                      
CONECT   33   12                                                      
CONECT   34   14                                                      
CONECT   35   14                                                      
CONECT   36   15                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   18                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   23                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
