COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -1.869   0.458   0.238  1.00  0.00           N  
HETATM    2  C   UNL     1      -4.038   1.501  -0.197  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.664   2.684   0.697  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.081   2.385   2.139  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.360   1.128   2.628  1.00  0.00           C  
HETATM    6  C   UNL     1       0.666  -2.716  -0.105  1.00  0.00           C  
HETATM    7  O   UNL     1      -2.839   1.072  -2.180  1.00  0.00           O  
HETATM    8  C   UNL     1      -3.627   1.794  -1.617  1.00  0.00           C  
HETATM    9  O   UNL     1      -4.137   2.859  -2.257  1.00  0.00           O  
HETATM   10  C   UNL     1      -3.735  -0.056   1.734  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.318   0.243   0.292  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.014  -0.623   0.121  1.00  0.00           C  
HETATM   13  N   UNL     1       0.295  -0.396   0.064  1.00  0.00           N  
HETATM   14  C   UNL     1       1.165  -1.390  -0.047  1.00  0.00           C  
HETATM   15  C   UNL     1       1.514  -3.822  -0.222  1.00  0.00           C  
HETATM   16  C   UNL     1       0.979  -5.076  -0.273  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.398  -5.269  -0.210  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.251  -4.212  -0.095  1.00  0.00           C  
HETATM   19  C   UNL     1      -0.735  -2.909  -0.045  1.00  0.00           C  
HETATM   20  N   UNL     1      -1.531  -1.836   0.067  1.00  0.00           N  
HETATM   21  N   UNL     1       2.520  -1.141  -0.106  1.00  0.00           N  
HETATM   22  C   UNL     1       2.987   0.175  -0.165  1.00  0.00           C  
HETATM   23  C   UNL     1       2.244   1.148  -0.822  1.00  0.00           C  
HETATM   24  C   UNL     1       2.708   2.448  -0.879  1.00  0.00           C  
HETATM   25  C   UNL     1       3.911   2.781  -0.284  1.00  0.00           C  
HETATM   26  C   UNL     1       4.653   1.814   0.371  1.00  0.00           C  
HETATM   27  C   UNL     1       4.192   0.515   0.437  1.00  0.00           C  
HETATM   28  C   UNL     1       5.960   2.183   1.024  1.00  0.00           C  
HETATM   29  N   UNL     1       7.055   2.006   0.061  1.00  0.00           N  
HETATM   30  H   UNL     1      -1.510   1.358   0.279  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.116   1.341  -0.156  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.586   2.843   0.657  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.177   3.580   0.349  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.814   3.228   2.776  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.158   2.226   2.180  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.283   1.288   2.588  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.657   0.915   3.655  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.844   3.006  -3.166  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.221  -0.951   2.083  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.812  -0.215   1.775  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.584  -0.600  -0.345  1.00  0.00           H  
HETATM   42  H   UNL     1       2.584  -3.685  -0.273  1.00  0.00           H  
HETATM   43  H   UNL     1       1.633  -5.931  -0.364  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.797  -6.272  -0.252  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.317  -4.376  -0.048  1.00  0.00           H  
HETATM   46  H   UNL     1       3.149  -1.879  -0.106  1.00  0.00           H  
HETATM   47  H   UNL     1       1.305   0.888  -1.288  1.00  0.00           H  
HETATM   48  H   UNL     1       2.131   3.205  -1.389  1.00  0.00           H  
HETATM   49  H   UNL     1       4.272   3.798  -0.330  1.00  0.00           H  
HETATM   50  H   UNL     1       4.772  -0.239   0.948  1.00  0.00           H  
HETATM   51  H   UNL     1       5.925   3.224   1.346  1.00  0.00           H  
HETATM   52  H   UNL     1       6.129   1.541   1.888  1.00  0.00           H  
HETATM   53  H   UNL     1       6.890   2.542  -0.778  1.00  0.00           H  
HETATM   54  H   UNL     1       7.943   2.247   0.475  1.00  0.00           H  
CONECT    1   11   12   30                                            
CONECT    2   11    3    8   31                                       
CONECT    3    4    2   32   33                                       
CONECT    4    5    3   34   35                                       
CONECT    5   10    4   36   37                                       
CONECT    6   14   14   19   15                                       
CONECT    7    8    8                                                 
CONECT    8    2    7    7    9                                       
CONECT    9    8   38                                                 
CONECT   10    5   11   39   40                                       
CONECT   11   10    1    2   41                                       
CONECT   12    1   13   13   20                                       
CONECT   13   12   12   14                                            
CONECT   14   13   21    6    6                                       
CONECT   15    6   16   16   42                                       
CONECT   16   15   15   17   43                                       
CONECT   17   18   18   16   44                                       
CONECT   18   19   17   17   45                                       
CONECT   19   20   20    6   18                                       
CONECT   20   12   19   19                                            
CONECT   21   22   14   46                                            
CONECT   22   27   21   23   23                                       
CONECT   23   22   22   24   47                                       
CONECT   24   25   25   23   48                                       
CONECT   25   26   24   24   49                                       
CONECT   26   28   27   27   25                                       
CONECT   27   26   26   22   50                                       
CONECT   28   26   29   51   52                                       
CONECT   29   28   53   54                                            
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   21                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
