COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.298  -0.977  -0.800  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.327  -2.311  -1.092  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.696  -2.217  -0.989  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.540  -1.159  -1.005  1.00  0.00           C  
HETATM    5  C   UNL     1       0.928  -1.257  -1.115  1.00  0.00           C  
HETATM    6  C   UNL     1       3.143  -0.241  -1.141  1.00  0.00           C  
HETATM    7  C   UNL     1       3.745  -0.631   0.192  1.00  0.00           C  
HETATM    8  C   UNL     1       3.345  -1.587   1.112  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.244   0.023   0.124  1.00  0.00           C  
HETATM   10  C   UNL     1       2.868   2.248  -0.957  1.00  0.00           C  
HETATM   11  C   UNL     1       3.750   1.139  -1.470  1.00  0.00           C  
HETATM   12  C   UNL     1       5.089   1.103  -0.702  1.00  0.00           C  
HETATM   13  C   UNL     1       4.863   0.141   0.444  1.00  0.00           C  
HETATM   14  C   UNL     1       5.581  -0.044   1.619  1.00  0.00           C  
HETATM   15  C   UNL     1       5.177  -1.002   2.536  1.00  0.00           C  
HETATM   16  C   UNL     1       4.059  -1.772   2.281  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.189   1.042   1.180  1.00  0.00           C  
HETATM   18  C   UNL     1      -8.303   0.559   2.110  1.00  0.00           C  
HETATM   19  C   UNL     1      -8.639   1.445   0.910  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.517   0.172  -0.713  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.147   0.085  -0.815  1.00  0.00           C  
HETATM   22  N   UNL     1       1.686  -0.145  -1.032  1.00  0.00           N  
HETATM   23  N   UNL     1      -4.685  -0.884  -0.702  1.00  0.00           N  
HETATM   24  N   UNL     1      -6.582   0.056   0.282  1.00  0.00           N  
HETATM   25  O   UNL     1       2.969   2.620   0.188  1.00  0.00           O  
HETATM   26  O   UNL     1       6.680   0.714   1.869  1.00  0.00           O  
HETATM   27  O   UNL     1      -4.540   0.811   0.726  1.00  0.00           O  
HETATM   28  O   UNL     1       1.455  -2.340  -1.281  1.00  0.00           O  
HETATM   29  O   UNL     1       1.970   2.823  -1.773  1.00  0.00           O  
HETATM   30  H   UNL     1      -0.861  -3.274  -1.238  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.305  -3.107  -1.055  1.00  0.00           H  
HETATM   32  H   UNL     1       3.417  -0.967  -1.906  1.00  0.00           H  
HETATM   33  H   UNL     1       2.472  -2.190   0.914  1.00  0.00           H  
HETATM   34  H   UNL     1       3.918   1.243  -2.542  1.00  0.00           H  
HETATM   35  H   UNL     1       5.887   0.739  -1.350  1.00  0.00           H  
HETATM   36  H   UNL     1       5.334   2.095  -0.323  1.00  0.00           H  
HETATM   37  H   UNL     1       5.735  -1.146   3.449  1.00  0.00           H  
HETATM   38  H   UNL     1       3.742  -2.518   2.994  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.515   1.811   1.559  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.585  -0.493   2.054  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.363   1.009   3.101  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.920   2.479   1.110  1.00  0.00           H  
HETATM   43  H   UNL     1      -9.142   0.977   0.064  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.987   1.134  -0.567  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.542   0.977  -0.748  1.00  0.00           H  
HETATM   46  H   UNL     1       1.265   0.719  -0.900  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.249  -1.472  -1.229  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.143  -0.572  -0.198  1.00  0.00           H  
HETATM   49  H   UNL     1       6.492   1.534   2.345  1.00  0.00           H  
HETATM   50  H   UNL     1       1.427   3.530  -1.399  1.00  0.00           H  
CONECT    1    3    3   23   20                                       
CONECT    2    4    4    3   30                                       
CONECT    3    2    1    1   31                                       
CONECT    4    2    2    5   21                                       
CONECT    5   22    4   28   28                                       
CONECT    6    7   22   11   32                                       
CONECT    7    8    8    6   13                                       
CONECT    8   16    7    7   33                                       
CONECT    9   23   24   27   27                                       
CONECT   10   25   25   11   29                                       
CONECT   11   12   10    6   34                                       
CONECT   12   11   13   35   36                                       
CONECT   13   12   14   14    7                                       
CONECT   14   13   13   26   15                                       
CONECT   15   14   16   16   37                                       
CONECT   16   15   15    8   38                                       
CONECT   17   24   18   19   39                                       
CONECT   18   17   19   40   41                                       
CONECT   19   18   17   42   43                                       
CONECT   20    1   21   21   44                                       
CONECT   21   20   20    4   45                                       
CONECT   22    6    5   46                                            
CONECT   23    9    1   47                                            
CONECT   24   17    9   48                                            
CONECT   25   10   10                                                 
CONECT   26   14   49                                                 
CONECT   27    9    9                                                 
CONECT   28    5    5                                                 
CONECT   29   10   50                                                 
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    6                                                      
CONECT   33    8                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   15                                                      
CONECT   38   16                                                      
CONECT   39   17                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   26                                                      
CONECT   50   29                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
