COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.130  -0.312  -1.784  1.00  0.00           C  
HETATM    2  C   UNL     1       1.073   0.336  -2.799  1.00  0.00           C  
HETATM    3  C   UNL     1       2.520  -0.023  -2.453  1.00  0.00           C  
HETATM    4  C   UNL     1       3.463   0.625  -3.467  1.00  0.00           C  
HETATM    5  C   UNL     1       4.888   0.270  -3.127  1.00  0.00           C  
HETATM    6  N   UNL     1       5.915   0.742  -3.901  1.00  0.00           N  
HETATM    7  N   UNL     1       5.141  -0.478  -2.104  1.00  0.00           N  
HETATM    8  O   UNL     1      -1.622  -1.640  -3.745  1.00  0.00           O  
HETATM    9  O   UNL     1      -1.955   0.414  -4.486  1.00  0.00           O  
HETATM   10  O   UNL     1      -4.597  -1.324  -1.059  1.00  0.00           O  
HETATM   11  C   UNL     1      -2.259  -0.601  -1.115  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.017   0.903   0.552  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.027  -0.022   0.263  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.726  -0.263  -1.456  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.979   1.004  -0.613  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.034  -0.279   1.187  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.025   0.386   2.409  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.023   1.315   2.696  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.011   1.568   1.768  1.00  0.00           C  
HETATM   20  C   UNL     1       0.042   0.109   3.402  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.269   0.028   4.758  1.00  0.00           C  
HETATM   22  C   UNL     1       0.724  -0.229   5.678  1.00  0.00           C  
HETATM   23  C   UNL     1       2.035  -0.408   5.255  1.00  0.00           C  
HETATM   24  C   UNL     1       2.348  -0.328   3.905  1.00  0.00           C  
HETATM   25  C   UNL     1       1.357  -0.076   2.979  1.00  0.00           C  
HETATM   26  O   UNL     1       3.012  -0.663   6.164  1.00  0.00           O  
HETATM   27  C   UNL     1      -1.316   0.047  -2.130  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.642  -0.454  -3.513  1.00  0.00           C  
HETATM   29  H   UNL     1       0.252  -1.395  -1.816  1.00  0.00           H  
HETATM   30  H   UNL     1       0.366   0.051  -0.784  1.00  0.00           H  
HETATM   31  H   UNL     1       0.951   1.419  -2.767  1.00  0.00           H  
HETATM   32  H   UNL     1       0.838  -0.026  -3.799  1.00  0.00           H  
HETATM   33  H   UNL     1       2.642  -1.106  -2.484  1.00  0.00           H  
HETATM   34  H   UNL     1       2.756   0.339  -1.453  1.00  0.00           H  
HETATM   35  H   UNL     1       3.341   1.708  -3.436  1.00  0.00           H  
HETATM   36  H   UNL     1       3.227   0.262  -4.468  1.00  0.00           H  
HETATM   37  H   UNL     1       6.832   0.513  -3.682  1.00  0.00           H  
HETATM   38  H   UNL     1       5.725   1.301  -4.671  1.00  0.00           H  
HETATM   39  H   UNL     1       4.413  -0.812  -1.556  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.164   0.092  -5.374  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.494  -1.053  -1.298  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.113  -1.681  -1.102  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.838  -0.049  -2.519  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.768   1.897  -1.200  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.008   1.020  -0.253  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.262  -1.000   0.960  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.023   1.836   3.642  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.785   2.288   1.990  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.288   0.167   5.088  1.00  0.00           H  
HETATM   50  H   UNL     1       0.484  -0.292   6.729  1.00  0.00           H  
HETATM   51  H   UNL     1       3.368  -0.468   3.578  1.00  0.00           H  
HETATM   52  H   UNL     1       1.601  -0.014   1.929  1.00  0.00           H  
HETATM   53  H   UNL     1       3.060  -1.623   6.261  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.438   1.130  -2.099  1.00  0.00           H  
CONECT    1    2   27   29   30                                       
CONECT    2    1    3   31   32                                       
CONECT    3    2    4   33   34                                       
CONECT    4    3    5   35   36                                       
CONECT    5    4    6    7    7                                       
CONECT    6    5   37   38                                            
CONECT    7    5    5   39                                            
CONECT    8   28   28                                                 
CONECT    9   28   40                                                 
CONECT   10   14   41                                                 
CONECT   11   13   14   27   42                                       
CONECT   12   13   13   15   19                                       
CONECT   13   11   12   12   16                                       
CONECT   14   10   11   15   43                                       
CONECT   15   12   14   44   45                                       
CONECT   16   13   17   17   46                                       
CONECT   17   16   16   18   20                                       
CONECT   18   17   19   19   47                                       
CONECT   19   12   18   18   48                                       
CONECT   20   17   21   21   25                                       
CONECT   21   20   20   22   49                                       
CONECT   22   21   23   23   50                                       
CONECT   23   22   22   24   26                                       
CONECT   24   23   25   25   51                                       
CONECT   25   20   24   24   52                                       
CONECT   26   23   53                                                 
CONECT   27    1   11   28   54                                       
CONECT   28    8    8    9   27                                       
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    2                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    6                                                      
CONECT   38    6                                                      
CONECT   39    7                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
