COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.591   3.992   0.801  1.00  0.00           C  
HETATM    2  C   UNL     1       1.342   2.534   0.516  1.00  0.00           C  
HETATM    3  C   UNL     1       2.404   1.656   0.434  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.559   1.439  -0.158  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.225   2.315  -1.367  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.997   0.933  -0.276  1.00  0.00           C  
HETATM    7  C   UNL     1       0.048   2.076   0.341  1.00  0.00           C  
HETATM    8  C   UNL     1       2.172   0.308   0.170  1.00  0.00           C  
HETATM    9  C   UNL     1       3.309  -0.640   0.082  1.00  0.00           C  
HETATM   10  C   UNL     1       3.078  -1.987  -0.189  1.00  0.00           C  
HETATM   11  C   UNL     1       4.140  -2.865  -0.270  1.00  0.00           C  
HETATM   12  C   UNL     1       5.432  -2.409  -0.084  1.00  0.00           C  
HETATM   13  C   UNL     1       5.668  -1.073   0.185  1.00  0.00           C  
HETATM   14  C   UNL     1       4.614  -0.186   0.263  1.00  0.00           C  
HETATM   15  C   UNL     1       0.867  -0.147  -0.011  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.189   0.738   0.084  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.600   0.248  -0.111  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.982  -0.667   1.024  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.263  -0.356   2.348  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.245   1.023   2.956  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.107  -2.020   0.871  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.833  -1.878  -1.421  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.696  -0.533  -1.398  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.640   0.176  -2.640  1.00  0.00           C  
HETATM   25  N   UNL     1      -2.546  -1.472   2.977  1.00  0.00           N  
HETATM   26  N   UNL     1      -2.452  -2.533   2.063  1.00  0.00           N  
HETATM   27  N   UNL     1      -1.907  -2.498  -2.644  1.00  0.00           N  
HETATM   28  N   UNL     1      -1.595   0.739  -3.626  1.00  0.00           N  
HETATM   29  O   UNL     1       1.769   4.695  -0.430  1.00  0.00           O  
HETATM   30  O   UNL     1      -1.900  -2.645  -0.315  1.00  0.00           O  
HETATM   31  H   UNL     1       0.739   4.409   1.338  1.00  0.00           H  
HETATM   32  H   UNL     1       2.489   4.095   1.411  1.00  0.00           H  
HETATM   33  H   UNL     1       3.413   2.014   0.575  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.454   2.026   0.755  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.619   3.319  -1.209  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.143   2.365  -1.492  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.674   1.885  -2.262  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.102   0.346  -1.189  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.235   0.309   0.585  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.680   1.782  -0.310  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.780   2.766   0.406  1.00  0.00           H  
HETATM   42  H   UNL     1       2.069  -2.344  -0.333  1.00  0.00           H  
HETATM   43  H   UNL     1       3.961  -3.909  -0.479  1.00  0.00           H  
HETATM   44  H   UNL     1       6.261  -3.100  -0.149  1.00  0.00           H  
HETATM   45  H   UNL     1       6.680  -0.723   0.330  1.00  0.00           H  
HETATM   46  H   UNL     1       4.800   0.858   0.468  1.00  0.00           H  
HETATM   47  H   UNL     1       0.681  -1.190  -0.216  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.234   1.472   2.864  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.974   0.952   4.009  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.515   1.641   2.433  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.005  -3.462  -2.693  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.861  -1.973  -3.458  1.00  0.00           H  
HETATM   53  H   UNL     1       1.934   5.642  -0.322  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.609  -3.470   2.257  1.00  0.00           H  
CONECT    1    2   29   31   32                                       
CONECT    2    7    7    3    1                                       
CONECT    3    8    8    2   33                                       
CONECT    4    6   17    5   34                                       
CONECT    5    4   35   36   37                                       
CONECT    6    4   38   39   40                                       
CONECT    7   16    2    2   41                                       
CONECT    8   15    9    3    3                                       
CONECT    9   10    8   14   14                                       
CONECT   10   11   11    9   42                                       
CONECT   11   10   10   12   43                                       
CONECT   12   11   13   13   44                                       
CONECT   13   12   12   14   45                                       
CONECT   14    9    9   13   46                                       
CONECT   15   16   16    8   47                                       
CONECT   16   17   15   15    7                                       
CONECT   17   23   18    4   16                                       
CONECT   18   21   21   17   19                                       
CONECT   19   18   25   25   20                                       
CONECT   20   19   48   49   50                                       
CONECT   21   30   26   18   18                                       
CONECT   22   27   30   23   23                                       
CONECT   23   22   22   24   17                                       
CONECT   24   28   28   28   23                                       
CONECT   25   26   19   19                                            
CONECT   26   21   25   54                                            
CONECT   27   22   51   52                                            
CONECT   28   24   24   24                                            
CONECT   29    1   53                                                 
CONECT   30   22   21                                                 
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   29                                                      
CONECT   54   26                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
