COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.106  -0.905   0.216  1.00  0.00           C  
HETATM    2  C   UNL     1       0.795  -0.173   0.336  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.993  -0.102  -0.012  1.00  0.00           C  
HETATM    4  C   UNL     1       5.527   0.733  -0.079  1.00  0.00           C  
HETATM    5  C   UNL     1       6.199   2.742  -0.954  1.00  0.00           C  
HETATM    6  C   UNL     1       7.512   2.449  -0.614  1.00  0.00           C  
HETATM    7  C   UNL     1       6.847   0.441   0.261  1.00  0.00           C  
HETATM    8  C   UNL     1       3.296  -2.772  -0.943  1.00  0.00           C  
HETATM    9  C   UNL     1       3.200  -3.810  -2.062  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.036  -0.805  -0.882  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.316  -0.009  -0.873  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.525   0.975  -1.822  1.00  0.00           C  
HETATM   13  C   UNL     1      -7.698   1.705  -1.814  1.00  0.00           C  
HETATM   14  C   UNL     1      -8.663   1.452  -0.857  1.00  0.00           C  
HETATM   15  C   UNL     1      -8.454   0.469   0.092  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.283  -0.266   0.080  1.00  0.00           C  
HETATM   17  B   UNL     1      -2.007  -0.025   2.249  1.00  0.00           B  
HETATM   18  C   UNL     1      -2.694  -0.911  -0.021  1.00  0.00           C  
HETATM   19  C   UNL     1       2.010  -1.944  -0.903  1.00  0.00           C  
HETATM   20  C   UNL     1       4.449  -0.234   0.235  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.609  -0.141   0.735  1.00  0.00           C  
HETATM   22  N   UNL     1       3.173   0.050  -0.094  1.00  0.00           N  
HETATM   23  N   UNL     1       5.238   1.883  -0.681  1.00  0.00           N  
HETATM   24  N   UNL     1       7.805   1.308  -0.016  1.00  0.00           N  
HETATM   25  N   UNL     1      -0.334  -0.853   0.619  1.00  0.00           N  
HETATM   26  O   UNL     1      -2.090  -1.193   3.053  1.00  0.00           O  
HETATM   27  O   UNL     1      -2.285   1.248   2.815  1.00  0.00           O  
HETATM   28  O   UNL     1       4.714  -1.281   0.790  1.00  0.00           O  
HETATM   29  O   UNL     1       0.755   1.029   0.177  1.00  0.00           O  
HETATM   30  H   UNL     1       2.330  -1.406   1.158  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.802   0.896  -0.407  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.365  -0.024   1.010  1.00  0.00           H  
HETATM   33  H   UNL     1       5.964   3.676  -1.443  1.00  0.00           H  
HETATM   34  H   UNL     1       8.297   3.156  -0.840  1.00  0.00           H  
HETATM   35  H   UNL     1       7.087  -0.491   0.751  1.00  0.00           H  
HETATM   36  H   UNL     1       3.432  -3.279   0.013  1.00  0.00           H  
HETATM   37  H   UNL     1       4.146  -2.115  -1.129  1.00  0.00           H  
HETATM   38  H   UNL     1       2.351  -4.467  -1.876  1.00  0.00           H  
HETATM   39  H   UNL     1       3.065  -3.303  -3.017  1.00  0.00           H  
HETATM   40  H   UNL     1       4.116  -4.400  -2.090  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.664  -0.883  -1.904  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.227  -1.803  -0.487  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.771   1.173  -2.570  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.861   2.474  -2.555  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.580   2.023  -0.850  1.00  0.00           H  
HETATM   46  H   UNL     1      -9.208   0.271   0.840  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.120  -1.035   0.821  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.861  -1.873   0.464  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.374  -1.073  -1.050  1.00  0.00           H  
HETATM   50  H   UNL     1       1.161  -2.601  -0.717  1.00  0.00           H  
HETATM   51  H   UNL     1       1.875  -1.437  -1.859  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.508   0.857   0.308  1.00  0.00           H  
HETATM   53  H   UNL     1       2.961   0.887  -0.537  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.302  -1.814   0.746  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.884  -2.011   2.580  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.279   1.972   2.175  1.00  0.00           H  
CONECT    1    2   19   22   30                                       
CONECT    2   25   29   29    1                                       
CONECT    3   10   18   31   32                                       
CONECT    4   20    7    7   23                                       
CONECT    5   23   23    6   33                                       
CONECT    6   24   24    5   34                                       
CONECT    7    4    4   24   35                                       
CONECT    8    9   19   36   37                                       
CONECT    9    8   38   39   40                                       
CONECT   10   11    3   41   42                                       
CONECT   11   16   16   12   10                                       
CONECT   12   13   13   11   43                                       
CONECT   13   14   12   12   44                                       
CONECT   14   15   15   13   45                                       
CONECT   15   14   14   16   46                                       
CONECT   16   15   11   11   47                                       
CONECT   17   26   21   27                                            
CONECT   18    3   21   48   49                                       
CONECT   19    8    1   50   51                                       
CONECT   20   28   28   22    4                                       
CONECT   21   18   17   25   52                                       
CONECT   22    1   20   53                                            
CONECT   23    4    5    5                                            
CONECT   24    7    6    6                                            
CONECT   25   21    2   54                                            
CONECT   26   17   55                                                 
CONECT   27   17   56                                                 
CONECT   28   20   20                                                 
CONECT   29    2    2                                                 
CONECT   30    1                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
