COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.716  -3.198   1.078  1.00  0.00           C  
HETATM    2  C   UNL     1       2.905  -1.377  -0.224  1.00  0.00           C  
HETATM    3  C   UNL     1       1.598  -1.831  -0.139  1.00  0.00           C  
HETATM    4  N   UNL     1      -4.589   2.285   0.538  1.00  0.00           N  
HETATM    5  C   UNL     1       3.168  -0.113  -0.751  1.00  0.00           C  
HETATM    6  C   UNL     1       4.891   0.550  -2.232  1.00  0.00           C  
HETATM    7  C   UNL     1       4.660   1.587  -0.056  1.00  0.00           C  
HETATM    8  C   UNL     1       6.149   1.926   0.039  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.792  -0.595  -0.248  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.124  -1.032  -0.286  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.126  -0.138  -0.036  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.490   1.548   0.272  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.476   2.921   0.584  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.818   3.320   0.737  1.00  0.00           C  
HETATM   15  C   UNL     1      -7.187  -2.170  -0.992  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.817  -2.647   0.414  1.00  0.00           C  
HETATM   17  N   UNL     1      -0.400   4.413   0.827  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.318   3.753   0.719  1.00  0.00           C  
HETATM   19  N   UNL     1      -3.802   1.165   0.246  1.00  0.00           N  
HETATM   20  N   UNL     1      -5.444  -0.539  -0.066  1.00  0.00           N  
HETATM   21  C   UNL     1      -5.782  -1.914  -0.443  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.516   0.671   0.028  1.00  0.00           N  
HETATM   23  N   UNL     1      -0.765  -1.488  -0.498  1.00  0.00           N  
HETATM   24  C   UNL     1       0.556  -1.030  -0.584  1.00  0.00           C  
HETATM   25  C   UNL     1       0.822   0.226  -1.114  1.00  0.00           C  
HETATM   26  C   UNL     1       2.123   0.683  -1.195  1.00  0.00           C  
HETATM   27  N   UNL     1       4.488   0.352  -0.833  1.00  0.00           N  
HETATM   28  N   UNL     1       6.321   3.161   0.816  1.00  0.00           N  
HETATM   29  N   UNL     1       3.960  -2.184   0.225  1.00  0.00           N  
HETATM   30  O   UNL     1       2.602  -3.354   1.532  1.00  0.00           O  
HETATM   31  C   UNL     1       4.826  -4.142   1.463  1.00  0.00           C  
HETATM   32  H   UNL     1       1.391  -2.808   0.273  1.00  0.00           H  
HETATM   33  H   UNL     1       4.233   1.283  -2.699  1.00  0.00           H  
HETATM   34  H   UNL     1       5.919   0.911  -2.266  1.00  0.00           H  
HETATM   35  H   UNL     1       4.820  -0.396  -2.768  1.00  0.00           H  
HETATM   36  H   UNL     1       4.255   1.444   0.947  1.00  0.00           H  
HETATM   37  H   UNL     1       4.132   2.403  -0.548  1.00  0.00           H  
HETATM   38  H   UNL     1       6.677   1.110   0.532  1.00  0.00           H  
HETATM   39  H   UNL     1       6.554   2.069  -0.963  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.355  -2.063  -0.510  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.154   4.317   0.980  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.293  -2.927  -1.769  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.859  -1.316  -1.073  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.246  -2.106   1.258  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.680  -3.718   0.562  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.148   0.089   0.162  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.965  -2.503  -0.858  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.959  -2.431  -0.615  1.00  0.00           H  
HETATM   49  H   UNL     1       0.009   0.848  -1.460  1.00  0.00           H  
HETATM   50  H   UNL     1       2.327   1.661  -1.607  1.00  0.00           H  
HETATM   51  H   UNL     1       7.297   3.407   0.893  1.00  0.00           H  
HETATM   52  H   UNL     1       5.788   3.918   0.415  1.00  0.00           H  
HETATM   53  H   UNL     1       4.865  -2.012  -0.078  1.00  0.00           H  
HETATM   54  H   UNL     1       4.854  -4.975   0.761  1.00  0.00           H  
HETATM   55  H   UNL     1       5.778  -3.612   1.438  1.00  0.00           H  
HETATM   56  H   UNL     1       4.648  -4.521   2.470  1.00  0.00           H  
CONECT    1   29   31   30   30                                       
CONECT    2    5    5    3   29                                       
CONECT    3   24   24    2   32                                       
CONECT    4   19   14   14                                            
CONECT    5   26   27    2    2                                       
CONECT    6   27   33   34   35                                       
CONECT    7    8   27   36   37                                       
CONECT    8    7   28   38   39                                       
CONECT    9   10   23   22   22                                       
CONECT   10   11   11    9   40                                       
CONECT   11   20   10   10   19                                       
CONECT   12   19   22   13   13                                       
CONECT   13   12   12   14   18                                       
CONECT   14    4    4   13   41                                       
CONECT   15   16   21   42   43                                       
CONECT   16   15   21   44   45                                       
CONECT   17   18   18   18                                            
CONECT   18   13   17   17   17                                       
CONECT   19   11   12    4                                            
CONECT   20   21   11   46                                            
CONECT   21   15   16   20   47                                       
CONECT   22    9    9   12                                            
CONECT   23   24    9   48                                            
CONECT   24   25   23    3    3                                       
CONECT   25   26   26   24   49                                       
CONECT   26   25   25    5   50                                       
CONECT   27    7    5    6                                            
CONECT   28    8   51   52                                            
CONECT   29    2    1   53                                            
CONECT   30    1    1                                                 
CONECT   31    1   54   55   56                                       
CONECT   32    3                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40   10                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   16                                                      
CONECT   45   16                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   23                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   31                                                      
CONECT   55   31                                                      
CONECT   56   31                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
