COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.993  -0.401   0.823  1.00  0.00           C  
HETATM    2  C   UNL     1       2.485  -2.060  -1.259  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.271  -1.213  -0.421  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.609   0.615  -0.115  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.888  -0.711  -0.453  1.00  0.00           C  
HETATM    6  C   UNL     1       0.174  -1.566  -0.825  1.00  0.00           C  
HETATM    7  C   UNL     1       1.103   2.409   0.169  1.00  0.00           C  
HETATM    8  C   UNL     1       0.717   1.038  -0.167  1.00  0.00           C  
HETATM    9  C   UNL     1       1.735   0.126  -0.556  1.00  0.00           C  
HETATM   10  C   UNL     1       2.800   4.006   0.401  1.00  0.00           C  
HETATM   11  C   UNL     1       3.339   1.799  -0.291  1.00  0.00           C  
HETATM   12  C   UNL     1      -7.896   0.800   0.462  1.00  0.00           C  
HETATM   13  C   UNL     1       4.700   2.166  -0.364  1.00  0.00           C  
HETATM   14  C   UNL     1       5.072   3.438  -0.053  1.00  0.00           C  
HETATM   15  C   UNL     1       4.099   4.371   0.336  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.899   1.931   0.127  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.558   0.147   0.663  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.638  -0.930   0.085  1.00  0.00           C  
HETATM   19  C   UNL     1       2.585  -3.907   0.482  1.00  0.00           C  
HETATM   20  C   UNL     1       3.386  -4.187   1.613  1.00  0.00           C  
HETATM   21  C   UNL     1       4.277  -3.185   1.717  1.00  0.00           C  
HETATM   22  C   UNL     1       3.034  -2.750  -0.037  1.00  0.00           C  
HETATM   23  N   UNL     1      -3.261  -0.431   0.053  1.00  0.00           N  
HETATM   24  N   UNL     1      -0.098  -2.876  -1.159  1.00  0.00           N  
HETATM   25  N   UNL     1       1.421  -1.135  -0.860  1.00  0.00           N1+
HETATM   26  N   UNL     1       3.001   0.553  -0.600  1.00  0.00           N  
HETATM   27  N   UNL     1       2.414   2.734   0.092  1.00  0.00           N  
HETATM   28  O   UNL     1       0.271   3.230   0.508  1.00  0.00           O  
HETATM   29  O   UNL     1      -5.685   1.251  -0.259  1.00  0.00           O  
HETATM   30  O   UNL     1       4.060  -2.318   0.715  1.00  0.00           O  
HETATM   31  O   UNL     1      -2.521  -2.334  -0.822  1.00  0.00           O  
HETATM   32  H   UNL     1      -7.169  -0.716   1.852  1.00  0.00           H  
HETATM   33  H   UNL     1      -7.167  -1.229   0.136  1.00  0.00           H  
HETATM   34  H   UNL     1       3.283  -1.505  -1.752  1.00  0.00           H  
HETATM   35  H   UNL     1       2.081  -2.804  -1.946  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.399   1.293   0.173  1.00  0.00           H  
HETATM   37  H   UNL     1       2.057   4.730   0.702  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.514   0.566  -0.405  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.520   1.077   1.311  1.00  0.00           H  
HETATM   40  H   UNL     1       6.111   3.727  -0.105  1.00  0.00           H  
HETATM   41  H   UNL     1       4.388   5.381   0.583  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.274   2.535  -0.699  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.724   2.555   1.004  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.176   0.496   1.623  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.686  -1.823   0.709  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.958  -1.176  -0.927  1.00  0.00           H  
HETATM   47  H   UNL     1       1.771  -4.508   0.105  1.00  0.00           H  
HETATM   48  H   UNL     1       3.299  -5.042   2.267  1.00  0.00           H  
HETATM   49  H   UNL     1       5.038  -3.094   2.478  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.062   0.463   0.373  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.017  -3.179  -1.221  1.00  0.00           H  
HETATM   52  H   UNL     1       0.630  -3.493  -1.332  1.00  0.00           H  
HETATM   53  H   UNL     1       5.443   1.442  -0.664  1.00  0.00           H  
CONECT    1   17   12   32   33                                       
CONECT    2   22   25   34   35                                       
CONECT    3    5   31   31   23                                       
CONECT    4    8    5    5   36                                       
CONECT    5    4    4    6    3                                       
CONECT    6   25   25    5   24                                       
CONECT    7   27   28   28    8                                       
CONECT    8    7    9    9    4                                       
CONECT    9   26    8    8   25                                       
CONECT   10   15   15   27   37                                       
CONECT   11   13   27   26   26                                       
CONECT   12    1   16   38   39                                       
CONECT   13   14   14   11   53                                       
CONECT   14   15   13   13   40                                       
CONECT   15   14   10   10   41                                       
CONECT   16   29   12   42   43                                       
CONECT   17   18   29    1   44                                       
CONECT   18   23   17   45   46                                       
CONECT   19   20   22   22   47                                       
CONECT   20   19   21   21   48                                       
CONECT   21   20   20   30   49                                       
CONECT   22   19   19    2   30                                       
CONECT   23    3   18   50                                            
CONECT   24    6   51   52                                            
CONECT   25    9    2    6    6                                       
CONECT   26   11   11    9                                            
CONECT   27   10   11    7                                            
CONECT   28    7    7                                                 
CONECT   29   17   16                                                 
CONECT   30   21   22                                                 
CONECT   31    3    3                                                 
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    4                                                      
CONECT   37   10                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   21                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   13                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
