COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.522  -0.222   0.266  1.00  0.00           O  
HETATM    2  C   UNL     1      -0.511   0.982   0.097  1.00  0.00           C  
HETATM    3  N   UNL     1       0.661   1.647   0.061  1.00  0.00           N  
HETATM    4  C   UNL     1       1.845   0.963   0.214  1.00  0.00           C  
HETATM    5  C   UNL     1       3.155   1.706   0.173  1.00  0.00           C  
HETATM    6  C   UNL     1       4.290   0.734   0.364  1.00  0.00           C  
HETATM    7  C   UNL     1       4.868   0.123  -0.732  1.00  0.00           C  
HETATM    8  C   UNL     1       5.913  -0.772  -0.555  1.00  0.00           C  
HETATM    9  O   UNL     1       6.483  -1.374  -1.632  1.00  0.00           O  
HETATM   10  C   UNL     1       7.555  -2.283  -1.375  1.00  0.00           C  
HETATM   11  C   UNL     1       6.376  -1.050   0.723  1.00  0.00           C  
HETATM   12  C   UNL     1       5.796  -0.437   1.815  1.00  0.00           C  
HETATM   13  C   UNL     1       4.757   0.459   1.636  1.00  0.00           C  
HETATM   14  N   UNL     1       1.833  -0.317   0.393  1.00  0.00           N  
HETATM   15  C   UNL     1      -1.780   1.714  -0.073  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.772   3.098  -0.266  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.961   3.776  -0.425  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.166   3.092  -0.393  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.188   1.724  -0.202  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.000   1.025  -0.047  1.00  0.00           C  
HETATM   21  O   UNL     1      -3.020  -0.319   0.134  1.00  0.00           O  
HETATM   22  C   UNL     1      -4.301  -0.936   0.274  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.156  -2.247   1.052  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.521  -2.933   1.146  1.00  0.00           C  
HETATM   25  N   UNL     1      -6.030  -3.199  -0.205  1.00  0.00           N  
HETATM   26  C   UNL     1      -6.223  -1.952  -0.956  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.879  -1.236  -1.112  1.00  0.00           C  
HETATM   28  H   UNL     1       0.669   2.607  -0.073  1.00  0.00           H  
HETATM   29  H   UNL     1       3.261   2.204  -0.791  1.00  0.00           H  
HETATM   30  H   UNL     1       3.175   2.450   0.970  1.00  0.00           H  
HETATM   31  H   UNL     1       2.668  -0.799   0.501  1.00  0.00           H  
HETATM   32  H   UNL     1       4.505   0.341  -1.726  1.00  0.00           H  
HETATM   33  H   UNL     1       4.307   0.941   2.492  1.00  0.00           H  
HETATM   34  H   UNL     1       7.190  -1.747   0.863  1.00  0.00           H  
HETATM   35  H   UNL     1       7.198  -3.095  -0.740  1.00  0.00           H  
HETATM   36  H   UNL     1       7.918  -2.692  -2.318  1.00  0.00           H  
HETATM   37  H   UNL     1       8.365  -1.757  -0.871  1.00  0.00           H  
HETATM   38  H   UNL     1       6.156  -0.653   2.810  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.836   3.635  -0.292  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.954   4.845  -0.574  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.093   3.631  -0.518  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.131   1.199  -0.178  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.972  -0.266   0.811  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.455  -2.901   0.535  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.785  -2.035   2.055  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.024  -0.303  -1.656  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.189  -1.875  -1.664  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.418  -3.873   1.687  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.218  -2.283   1.675  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.421  -3.830  -0.704  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.630  -2.179  -1.941  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.917  -1.307  -0.416  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3   15                                       
CONECT    3    2    4   28                                            
CONECT    4    3    5   14   14                                       
CONECT    5    4    6   29   30                                       
CONECT    6    5    7   13   13                                       
CONECT    7    6    8    8   32                                       
CONECT    8    7    7    9   11                                       
CONECT    9    8   10                                                 
CONECT   10    9   35   36   37                                       
CONECT   11    8   12   12   34                                       
CONECT   12   11   11   13   38                                       
CONECT   13    6    6   12   33                                       
CONECT   14    4    4   31                                            
CONECT   15    2   16   20   20                                       
CONECT   16   15   17   17   39                                       
CONECT   17   16   16   18   40                                       
CONECT   18   17   19   19   41                                       
CONECT   19   18   18   20   42                                       
CONECT   20   15   15   19   21                                       
CONECT   21   20   22                                                 
CONECT   22   21   23   27   43                                       
CONECT   23   22   24   44   45                                       
CONECT   24   23   25   48   49                                       
CONECT   25   24   26   50                                            
CONECT   26   25   27   51   52                                       
CONECT   27   22   26   46   47                                       
CONECT   28    3                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31   14                                                      
CONECT   32    7                                                      
CONECT   33   13                                                      
CONECT   34   11                                                      
CONECT   35   10                                                      
CONECT   36   10                                                      
CONECT   37   10                                                      
CONECT   38   12                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   23                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
