COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.342  -0.859   0.065  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.374  -0.808  -1.064  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.462   0.627  -1.596  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.735   1.570  -0.418  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.674   1.340   0.661  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.917   2.302   1.826  1.00  0.00           C  
HETATM    7  O   UNL     1      -2.074  -0.426  -0.433  1.00  0.00           O  
HETATM    8  O   UNL     1      -3.975  -1.687  -2.117  1.00  0.00           O  
HETATM    9  O   UNL     1      -5.525   0.722  -2.546  1.00  0.00           O  
HETATM   10  O   UNL     1      -4.674   2.925  -0.867  1.00  0.00           O  
HETATM   11  O   UNL     1      -3.749  -0.004   1.132  1.00  0.00           O  
HETATM   12  O   UNL     1      -2.860   2.172   2.779  1.00  0.00           O  
HETATM   13  C   UNL     1       1.592  -1.624   1.012  1.00  0.00           C  
HETATM   14  C   UNL     1       0.472  -2.653   1.186  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.691  -2.288   0.256  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.094  -0.833   0.523  1.00  0.00           C  
HETATM   17  C   UNL     1       0.143   0.059   0.401  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.255   1.518   0.635  1.00  0.00           C  
HETATM   19  O   UNL     1       2.019  -1.613  -0.352  1.00  0.00           O  
HETATM   20  O   UNL     1       0.960  -3.954   0.853  1.00  0.00           O  
HETATM   21  O   UNL     1      -1.802  -3.148   0.513  1.00  0.00           O  
HETATM   22  O   UNL     1       1.116  -0.328   1.369  1.00  0.00           O  
HETATM   23  O   UNL     1       0.877   2.362   0.415  1.00  0.00           O  
HETATM   24  C   UNL     1       5.479   0.628  -0.500  1.00  0.00           C  
HETATM   25  C   UNL     1       4.840   0.424   0.709  1.00  0.00           C  
HETATM   26  C   UNL     1       3.681  -0.326   0.761  1.00  0.00           C  
HETATM   27  C   UNL     1       3.158  -0.875  -0.401  1.00  0.00           C  
HETATM   28  C   UNL     1       3.804  -0.673  -1.612  1.00  0.00           C  
HETATM   29  C   UNL     1       4.960   0.082  -1.660  1.00  0.00           C  
HETATM   30  N   UNL     1       6.720   1.433  -0.553  1.00  0.00           N1+
HETATM   31  O   UNL     1       7.178   1.914   0.467  1.00  0.00           O1-
HETATM   32  O   UNL     1       7.284   1.613  -1.618  1.00  0.00           O  
HETATM   33  H   UNL     1      -3.257  -1.881   0.432  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.348  -1.115  -0.681  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.520   0.899  -2.072  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.724   1.365  -0.009  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.685   1.522   0.241  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.867   2.062   2.302  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.946   3.325   1.452  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.927  -2.574  -1.737  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.317   0.104  -3.261  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.352   3.024  -1.549  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.051   2.793   3.494  1.00  0.00           H  
HETATM   44  H   UNL     1       2.432  -1.891   1.652  1.00  0.00           H  
HETATM   45  H   UNL     1       0.128  -2.646   2.220  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.377  -2.396  -0.782  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.507  -0.748   1.528  1.00  0.00           H  
HETATM   48  H   UNL     1       0.565  -0.045  -0.599  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.052   1.792  -0.055  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.604   1.639   1.661  1.00  0.00           H  
HETATM   51  H   UNL     1       1.689  -4.144   1.460  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.505  -4.051   0.333  1.00  0.00           H  
HETATM   53  H   UNL     1       0.584   3.270   0.573  1.00  0.00           H  
HETATM   54  H   UNL     1       5.248   0.851   1.613  1.00  0.00           H  
HETATM   55  H   UNL     1       3.182  -0.485   1.706  1.00  0.00           H  
HETATM   56  H   UNL     1       3.399  -1.099  -2.518  1.00  0.00           H  
HETATM   57  H   UNL     1       5.461   0.244  -2.603  1.00  0.00           H  
CONECT    1    2    7   11   33                                       
CONECT    2    1    3    8   34                                       
CONECT    3    2    4    9   35                                       
CONECT    4    3    5   10   36                                       
CONECT    5    4    6   11   37                                       
CONECT    6    5   12   38   39                                       
CONECT    7    1   16                                                 
CONECT    8    2   40                                                 
CONECT    9    3   41                                                 
CONECT   10    4   42                                                 
CONECT   11    1    5                                                 
CONECT   12    6   43                                                 
CONECT   13   14   19   22   44                                       
CONECT   14   13   15   20   45                                       
CONECT   15   14   16   21   46                                       
CONECT   16    7   15   17   47                                       
CONECT   17   16   18   22   48                                       
CONECT   18   17   23   49   50                                       
CONECT   19   13   27                                                 
CONECT   20   14   51                                                 
CONECT   21   15   52                                                 
CONECT   22   13   17                                                 
CONECT   23   18   53                                                 
CONECT   24   25   25   29   30                                       
CONECT   25   24   24   26   54                                       
CONECT   26   25   27   27   55                                       
CONECT   27   19   26   26   28                                       
CONECT   28   27   29   29   56                                       
CONECT   29   24   28   28   57                                       
CONECT   30   24   31   32   32                                       
CONECT   31   30                                                      
CONECT   32   30   30                                                 
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   23                                                      
CONECT   54   25                                                      
CONECT   55   26                                                      
CONECT   56   28                                                      
CONECT   57   29                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
