COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.110   0.440   0.216  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.066   2.970   2.052  1.00  0.00           C  
HETATM    3  C   UNL     1       0.253   0.084  -0.505  1.00  0.00           C  
HETATM    4  C   UNL     1       0.489  -1.582   1.348  1.00  0.00           C  
HETATM    5  C   UNL     1       2.685  -4.619   1.811  1.00  0.00           C  
HETATM    6  C   UNL     1       2.440  -2.959  -0.047  1.00  0.00           C  
HETATM    7  C   UNL     1       1.860  -1.832  -0.600  1.00  0.00           C  
HETATM    8  C   UNL     1       4.056   1.986  -0.426  1.00  0.00           C  
HETATM    9  C   UNL     1       5.744   1.991  -2.190  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.841   2.190   0.435  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.412   0.828   0.984  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.901  -0.583  -0.931  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.717  -0.960  -1.677  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.227  -0.140  -0.644  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.405   1.786   1.183  1.00  0.00           C  
HETATM   16  C   UNL     1       0.535   1.267   0.376  1.00  0.00           C  
HETATM   17  C   UNL     1       0.885  -1.144   0.098  1.00  0.00           C  
HETATM   18  C   UNL     1       1.073  -2.706   1.903  1.00  0.00           C  
HETATM   19  C   UNL     1       2.048  -3.394   1.206  1.00  0.00           C  
HETATM   20  C   UNL     1       1.822   1.852   0.353  1.00  0.00           C  
HETATM   21  C   UNL     1       4.988   1.288  -1.383  1.00  0.00           C  
HETATM   22  N   UNL     1      -3.456   0.209   0.062  1.00  0.00           N  
HETATM   23  N   UNL     1      -3.045  -1.162  -1.791  1.00  0.00           N  
HETATM   24  N   UNL     1      -1.664   1.255   1.228  1.00  0.00           N  
HETATM   25  O   UNL     1      -5.095  -0.777  -1.052  1.00  0.00           O  
HETATM   26  O   UNL     1      -0.947  -1.488  -2.460  1.00  0.00           O  
HETATM   27  O   UNL     1       2.067   2.811   1.061  1.00  0.00           O  
HETATM   28  O   UNL     1       2.779   1.346  -0.453  1.00  0.00           O  
HETATM   29  H   UNL     1      -0.941   3.254   2.636  1.00  0.00           H  
HETATM   30  H   UNL     1       0.750   2.705   2.725  1.00  0.00           H  
HETATM   31  H   UNL     1       0.239   3.806   1.423  1.00  0.00           H  
HETATM   32  H   UNL     1       0.683   0.261  -1.491  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.273  -1.044   1.893  1.00  0.00           H  
HETATM   34  H   UNL     1       3.562  -4.325   2.387  1.00  0.00           H  
HETATM   35  H   UNL     1       1.969  -5.114   2.466  1.00  0.00           H  
HETATM   36  H   UNL     1       2.985  -5.302   1.017  1.00  0.00           H  
HETATM   37  H   UNL     1       3.202  -3.497  -0.591  1.00  0.00           H  
HETATM   38  H   UNL     1       2.165  -1.493  -1.578  1.00  0.00           H  
HETATM   39  H   UNL     1       4.466   1.934   0.583  1.00  0.00           H  
HETATM   40  H   UNL     1       3.946   3.029  -0.721  1.00  0.00           H  
HETATM   41  H   UNL     1       6.412   1.492  -2.875  1.00  0.00           H  
HETATM   42  H   UNL     1       5.699   3.070  -2.169  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.311   2.056  -0.540  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.552   2.651   1.121  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.967   2.832   0.332  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.942   0.962   1.959  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.286   0.186   1.087  1.00  0.00           H  
HETATM   48  H   UNL     1       0.767  -3.046   2.881  1.00  0.00           H  
HETATM   49  H   UNL     1       5.033   0.210  -1.403  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.385  -1.727  -2.502  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.246   1.455   1.979  1.00  0.00           H  
CONECT    1   14   14   22   24                                       
CONECT    2   15   29   30   31                                       
CONECT    3   17   14   16   32                                       
CONECT    4   18   18   17   33                                       
CONECT    5   19   34   35   36                                       
CONECT    6   19   19    7   37                                       
CONECT    7    6   17   17   38                                       
CONECT    8   21   28   39   40                                       
CONECT    9   21   21   41   42                                       
CONECT   10   11   43   44   45                                       
CONECT   11   22   10   46   47                                       
CONECT   12   23   25   25   22                                       
CONECT   13   26   26   23   14                                       
CONECT   14   13    3    1    1                                       
CONECT   15   16   16   24    2                                       
CONECT   16    3   20   15   15                                       
CONECT   17    7    7    4    3                                       
CONECT   18   19    4    4   48                                       
CONECT   19    5    6    6   18                                       
CONECT   20   28   27   27   16                                       
CONECT   21    9    9    8   49                                       
CONECT   22   12    1   11                                            
CONECT   23   13   12   50                                            
CONECT   24    1   15   51                                            
CONECT   25   12   12                                                 
CONECT   26   13   13                                                 
CONECT   27   20   20                                                 
CONECT   28    8   20                                                 
CONECT   29    2                                                      
CONECT   30    2                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   18                                                      
CONECT   49   21                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
MASTER        0    0    0    0    0    0    0    0   51    0   51    0
END
