COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.745  -0.715   0.243  1.00  0.00           C  
HETATM    2  C   UNL     1       6.571  -1.953   0.605  1.00  0.00           C  
HETATM    3  C   UNL     1       8.047  -1.678   0.305  1.00  0.00           C  
HETATM    4  C   UNL     1       7.482  -0.152  -1.459  1.00  0.00           C  
HETATM    5  C   UNL     1       5.983  -0.366  -1.229  1.00  0.00           C  
HETATM    6  C   UNL     1       4.260  -1.007   0.466  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.977   0.629   0.565  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.655   3.245  -0.028  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.317   2.818  -0.062  1.00  0.00           C  
HETATM   10  C   UNL     1       0.884   3.465  -0.346  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.339   0.037   0.946  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.276  -1.249   0.387  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.305  -0.332   0.007  1.00  0.00           C  
HETATM   14  O   UNL     1      -6.236  -1.639  -0.493  1.00  0.00           O  
HETATM   15  C   UNL     1      -6.839  -2.121  -2.783  1.00  0.00           C  
HETATM   16  O   UNL     1       1.577  -0.839   0.689  1.00  0.00           O  
HETATM   17  O   UNL     1       8.194  -1.331  -1.074  1.00  0.00           O  
HETATM   18  N   UNL     1       3.481   0.211   0.230  1.00  0.00           N  
HETATM   19  C   UNL     1       2.141   0.191   0.368  1.00  0.00           C  
HETATM   20  C   UNL     1       1.363   1.408   0.132  1.00  0.00           C  
HETATM   21  N   UNL     1       0.001   1.517   0.240  1.00  0.00           N  
HETATM   22  C   UNL     1      -2.283   1.018   0.595  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.632   2.353   0.292  1.00  0.00           C  
HETATM   24  N   UNL     1       1.859   2.582  -0.231  1.00  0.00           N  
HETATM   25  C   UNL     1      -3.387  -0.525   2.220  1.00  0.00           C  
HETATM   26  N   UNL     1      -4.327  -1.392   2.538  1.00  0.00           N  
HETATM   27  C   UNL     1      -5.254  -1.763   1.676  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.121  -1.160  -1.834  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.757   0.228  -1.935  1.00  0.00           C  
HETATM   30  H   UNL     1       6.049   0.123   0.870  1.00  0.00           H  
HETATM   31  H   UNL     1       6.450  -2.174   1.666  1.00  0.00           H  
HETATM   32  H   UNL     1       6.231  -2.803   0.014  1.00  0.00           H  
HETATM   33  H   UNL     1       8.396  -0.853   0.926  1.00  0.00           H  
HETATM   34  H   UNL     1       8.634  -2.570   0.521  1.00  0.00           H  
HETATM   35  H   UNL     1       7.662   0.055  -2.514  1.00  0.00           H  
HETATM   36  H   UNL     1       7.824   0.692  -0.860  1.00  0.00           H  
HETATM   37  H   UNL     1       5.631  -1.184  -1.858  1.00  0.00           H  
HETATM   38  H   UNL     1       5.442   0.547  -1.480  1.00  0.00           H  
HETATM   39  H   UNL     1       3.935  -1.786  -0.225  1.00  0.00           H  
HETATM   40  H   UNL     1       4.106  -1.344   1.491  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.716  -0.393   0.797  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.907   4.269  -0.261  1.00  0.00           H  
HETATM   43  H   UNL     1       0.998   4.505  -0.613  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.296   0.086  -0.990  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.752  -1.755  -3.806  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.386  -3.109  -2.710  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.892  -2.183  -2.508  1.00  0.00           H  
HETATM   48  H   UNL     1       3.930   1.032  -0.026  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.665   2.665   0.323  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.646  -0.248   2.955  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.006  -2.476   1.978  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.068  -1.097  -2.108  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.245   0.913  -1.259  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.669   0.594  -2.958  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.810   0.166  -1.661  1.00  0.00           H  
CONECT    1    2    5    6   30                                       
CONECT    2    3    1   31   32                                       
CONECT    3   17    2   33   34                                       
CONECT    4   17    5   35   36                                       
CONECT    5    4    1   37   38                                       
CONECT    6    1   18   39   40                                       
CONECT    7   21   22   22   41                                       
CONECT    8    9   23   23   42                                       
CONECT    9   10   10   21    8                                       
CONECT   10   24    9    9   43                                       
CONECT   11   22   13   13   25                                       
CONECT   12   13   14   27   27                                       
CONECT   13   11   11   12   44                                       
CONECT   14   28   12                                                 
CONECT   15   28   45   46   47                                       
CONECT   16   19   19                                                 
CONECT   17    4    3                                                 
CONECT   18    6   19   48                                            
CONECT   19   18   16   16   20                                       
CONECT   20   19   24   24   21                                       
CONECT   21   20    9    7                                            
CONECT   22    7    7   23   11                                       
CONECT   23    8    8   22   49                                       
CONECT   24   20   20   10                                            
CONECT   25   11   26   26   50                                       
CONECT   26   25   25   27                                            
CONECT   27   12   12   26   51                                       
CONECT   28   15   29   14   52                                       
CONECT   29   28   53   54   55                                       
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    8                                                      
CONECT   43   10                                                      
CONECT   44   13                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   18                                                      
CONECT   49   23                                                      
CONECT   50   25                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
CONECT   55   29                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
