COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       1.350   1.987  -0.582  1.00  0.00           N  
HETATM    2  C   UNL     1       3.319  -3.011  -0.025  1.00  0.00           C  
HETATM    3  C   UNL     1       3.775  -1.690  -0.167  1.00  0.00           C  
HETATM    4  C   UNL     1       2.876  -0.693  -0.617  1.00  0.00           C  
HETATM    5  C   UNL     1       5.106  -1.342   0.128  1.00  0.00           C  
HETATM    6  C   UNL     1       5.539  -0.062  -0.012  1.00  0.00           C  
HETATM    7  C   UNL     1       3.358   0.681  -0.763  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.155   0.731   0.812  1.00  0.00           C  
HETATM    9  C   UNL     1       0.567   0.070   3.006  1.00  0.00           C  
HETATM   10  C   UNL     1       2.062   1.318   1.603  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.769   0.050  -0.438  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.175  -0.958  -2.046  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.833   0.799  -0.908  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.268  -0.224   0.713  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.956  -0.835   0.608  1.00  0.00           C  
HETATM   16  C   UNL     1       1.552  -1.038  -0.912  1.00  0.00           C  
HETATM   17  C   UNL     1       1.143  -2.330  -0.764  1.00  0.00           C  
HETATM   18  C   UNL     1       2.025  -3.313  -0.326  1.00  0.00           C  
HETATM   19  C   UNL     1       4.693   0.956  -0.451  1.00  0.00           C  
HETATM   20  O   UNL     1       5.168   2.220  -0.577  1.00  0.00           O  
HETATM   21  C   UNL     1       2.463   1.742  -1.225  1.00  0.00           C  
HETATM   22  C   UNL     1       1.093   1.355   0.598  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.404   0.093   2.028  1.00  0.00           C  
HETATM   24  C   UNL     1       1.795   0.677   2.794  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.189   0.760  -0.238  1.00  0.00           C  
HETATM   26  N   UNL     1      -2.381   0.167  -0.025  1.00  0.00           N  
HETATM   27  O   UNL     1      -0.967   1.317  -1.295  1.00  0.00           O  
HETATM   28  C   UNL     1      -3.409   0.195  -1.069  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.082   0.662  -0.332  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.205  -0.972   1.183  1.00  0.00           C  
HETATM   31  H   UNL     1       3.992  -3.784   0.317  1.00  0.00           H  
HETATM   32  H   UNL     1       5.791  -2.102   0.472  1.00  0.00           H  
HETATM   33  H   UNL     1       6.567   0.174   0.223  1.00  0.00           H  
HETATM   34  H   UNL     1       0.370  -0.426   3.945  1.00  0.00           H  
HETATM   35  H   UNL     1       3.019   1.793   1.448  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.940  -0.938  -2.823  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.191  -0.854  -2.503  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.227  -1.906  -1.510  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.687   1.490  -1.724  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.245  -0.331   1.162  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.125  -1.419   0.975  1.00  0.00           H  
HETATM   42  H   UNL     1       0.859  -0.284  -1.256  1.00  0.00           H  
HETATM   43  H   UNL     1       0.120  -2.595  -0.992  1.00  0.00           H  
HETATM   44  H   UNL     1       1.677  -4.330  -0.216  1.00  0.00           H  
HETATM   45  H   UNL     1       5.607   2.393  -1.421  1.00  0.00           H  
HETATM   46  H   UNL     1       2.721   2.324  -2.098  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.358  -0.383   2.202  1.00  0.00           H  
HETATM   48  H   UNL     1       2.547   0.651   3.569  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.558  -0.278   0.818  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.356   1.142  -1.606  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.912   1.247  -0.699  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.351  -1.663   2.000  1.00  0.00           H  
CONECT    1   21   21   22                                            
CONECT    2   18   18    3   31                                       
CONECT    3    2    5    5    4                                       
CONECT    4    3   16    7    7                                       
CONECT    5    3    3    6   32                                       
CONECT    6    5   19   19   33                                       
CONECT    7    4    4   19   21                                       
CONECT    8   22   25   23   23                                       
CONECT    9   24   24   23   34                                       
CONECT   10   22   22   24   35                                       
CONECT   11   28   15   15   13                                       
CONECT   12   28   36   37   38                                       
CONECT   13   11   29   29   39                                       
CONECT   14   30   30   29   40                                       
CONECT   15   11   11   30   41                                       
CONECT   16   17   17    4   42                                       
CONECT   17   18   16   16   43                                       
CONECT   18    2    2   17   44                                       
CONECT   19    6    6    7   20                                       
CONECT   20   19   45                                                 
CONECT   21    7    1    1   46                                       
CONECT   22    1   10   10    8                                       
CONECT   23    8    8    9   47                                       
CONECT   24   10    9    9   48                                       
CONECT   25    8   27   27   26                                       
CONECT   26   25   28   49                                            
CONECT   27   25   25                                                 
CONECT   28   12   26   11   50                                       
CONECT   29   13   13   14   51                                       
CONECT   30   15   14   14   52                                       
CONECT   31    2                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   26                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   30                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
