COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.310  -3.039   0.648  1.00  0.00           N  
HETATM    2  N   UNL     1      -3.822  -1.022   0.905  1.00  0.00           N  
HETATM    3  C   UNL     1      -0.414  -1.783   0.223  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.347  -3.670   1.168  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.736  -1.855   0.901  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.479   0.200   0.366  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.392   1.349   0.207  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.546   3.009  -0.556  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.169   0.182   0.004  1.00  0.00           C  
HETATM   10  C   UNL     1       3.054  -0.931   0.114  1.00  0.00           C  
HETATM   11  C   UNL     1       4.745  -0.506   1.750  1.00  0.00           C  
HETATM   12  C   UNL     1       5.747   2.834  -0.463  1.00  0.00           C  
HETATM   13  C   UNL     1       6.722   2.239   0.521  1.00  0.00           C  
HETATM   14  O   UNL     1       6.003   3.885  -1.013  1.00  0.00           O  
HETATM   15  O   UNL     1       6.007   1.506   1.520  1.00  0.00           O  
HETATM   16  C   UNL     1       5.029   0.673   1.080  1.00  0.00           C  
HETATM   17  C   UNL     1       3.735  -1.319   1.250  1.00  0.00           C  
HETATM   18  N   UNL     1       4.589   2.195  -0.733  1.00  0.00           N  
HETATM   19  C   UNL     1       4.298   1.003  -0.063  1.00  0.00           C  
HETATM   20  N   UNL     1       3.346   0.199  -0.504  1.00  0.00           N  
HETATM   21  C   UNL     1       1.963  -1.814  -0.434  1.00  0.00           C  
HETATM   22  C   UNL     1       2.249  -2.124  -1.906  1.00  0.00           C  
HETATM   23  C   UNL     1       3.555  -2.912  -2.017  1.00  0.00           C  
HETATM   24  C   UNL     1       1.101  -2.954  -2.484  1.00  0.00           C  
HETATM   25  N   UNL     1       0.675  -1.127  -0.321  1.00  0.00           N  
HETATM   26  C   UNL     1      -1.658  -1.141   0.340  1.00  0.00           C  
HETATM   27  N   UNL     1      -2.530  -3.109   1.297  1.00  0.00           N  
HETATM   28  C   UNL     1      -5.729   1.295  -0.187  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.477   0.118  -0.513  1.00  0.00           C  
HETATM   30  N   UNL     1      -7.070  -0.816  -0.772  1.00  0.00           N  
HETATM   31  N   UNL     1      -6.189   2.584  -0.201  1.00  0.00           N  
HETATM   32  N   UNL     1      -5.138   3.424   0.183  1.00  0.00           N  
HETATM   33  C   UNL     1      -4.078   2.702   0.431  1.00  0.00           C  
HETATM   34  H   UNL     1      -4.702  -1.257   1.237  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.219  -4.690   1.501  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.168   3.023   0.339  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.511   4.009  -0.990  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.967   2.313  -1.281  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.613   0.992  -0.445  1.00  0.00           H  
HETATM   40  H   UNL     1       5.294  -0.785   2.636  1.00  0.00           H  
HETATM   41  H   UNL     1       7.403   1.568  -0.004  1.00  0.00           H  
HETATM   42  H   UNL     1       7.293   3.037   0.995  1.00  0.00           H  
HETATM   43  H   UNL     1       3.486  -2.246   1.746  1.00  0.00           H  
HETATM   44  H   UNL     1       3.967   2.558  -1.382  1.00  0.00           H  
HETATM   45  H   UNL     1       1.930  -2.745   0.133  1.00  0.00           H  
HETATM   46  H   UNL     1       2.339  -1.191  -2.462  1.00  0.00           H  
HETATM   47  H   UNL     1       3.493  -3.807  -1.398  1.00  0.00           H  
HETATM   48  H   UNL     1       3.718  -3.199  -3.056  1.00  0.00           H  
HETATM   49  H   UNL     1       4.384  -2.292  -1.676  1.00  0.00           H  
HETATM   50  H   UNL     1       0.170  -2.392  -2.405  1.00  0.00           H  
HETATM   51  H   UNL     1       1.304  -3.174  -3.532  1.00  0.00           H  
HETATM   52  H   UNL     1       1.011  -3.887  -1.927  1.00  0.00           H  
HETATM   53  H   UNL     1       0.585  -0.211  -0.627  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.119   3.081   0.751  1.00  0.00           H  
CONECT    1    3    3    4                                            
CONECT    2    5    6   34                                            
CONECT    3   25    1    1   26                                       
CONECT    4    1   27   27   35                                       
CONECT    5   27    2   26   26                                       
CONECT    6    2    7    9    9                                       
CONECT    7    6   33   28   28                                       
CONECT    8   31   36   37   38                                       
CONECT    9    6    6   26   39                                       
CONECT   10   21   17   17   20                                       
CONECT   11   17   16   16   40                                       
CONECT   12   18   14   14   13                                       
CONECT   13   12   15   41   42                                       
CONECT   14   12   12                                                 
CONECT   15   13   16                                                 
CONECT   16   11   11   19   15                                       
CONECT   17   10   10   11   43                                       
CONECT   18   19   12   44                                            
CONECT   19   16   20   20   18                                       
CONECT   20   19   19   10                                            
CONECT   21   22   25   10   45                                       
CONECT   22   24   23   21   46                                       
CONECT   23   22   47   48   49                                       
CONECT   24   22   50   51   52                                       
CONECT   25   21    3   53                                            
CONECT   26    9    3    5    5                                       
CONECT   27    4    4    5                                            
CONECT   28   31    7    7   29                                       
CONECT   29   28   30   30   30                                       
CONECT   30   29   29   29                                            
CONECT   31   32    8   28                                            
CONECT   32   33   33   31                                            
CONECT   33    7   32   32   54                                       
CONECT   34    2                                                      
CONECT   35    4                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40   11                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
CONECT   50   24                                                      
CONECT   51   24                                                      
CONECT   52   24                                                      
CONECT   53   25                                                      
CONECT   54   33                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
