COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.648  -0.360   0.283  1.00  0.00           N  
HETATM    2  C   UNL     1      -4.596  -0.402   1.237  1.00  0.00           C  
HETATM    3  O   UNL     1      -4.636  -1.347   2.001  1.00  0.00           O  
HETATM    4  N   UNL     1      -5.500   0.587   1.357  1.00  0.00           N  
HETATM    5  C   UNL     1      -5.469   1.643   0.518  1.00  0.00           C  
HETATM    6  O   UNL     1      -6.286   2.539   0.627  1.00  0.00           O  
HETATM    7  C   UNL     1      -4.477   1.699  -0.490  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.582   0.693  -0.589  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.674  -1.449   0.180  1.00  0.00           C  
HETATM   10  C   UNL     1       2.849  -0.130  -0.455  1.00  0.00           C  
HETATM   11  C   UNL     1       3.991  -0.489   0.461  1.00  0.00           C  
HETATM   12  C   UNL     1       5.256  -0.693  -0.059  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.861  -2.196  -1.155  1.00  0.00           C  
HETATM   14  C   UNL     1       6.303  -1.022   0.781  1.00  0.00           C  
HETATM   15  C   UNL     1       6.086  -1.147   2.140  1.00  0.00           C  
HETATM   16  C   UNL     1       4.822  -0.943   2.660  1.00  0.00           C  
HETATM   17  C   UNL     1       3.775  -0.609   1.821  1.00  0.00           C  
HETATM   18  C   UNL     1       2.605   1.356  -0.395  1.00  0.00           C  
HETATM   19  N   UNL     1       2.026   1.992   0.586  1.00  0.00           N  
HETATM   20  C   UNL     1       1.980   3.302   0.298  1.00  0.00           C  
HETATM   21  C   UNL     1       2.553   3.483  -0.907  1.00  0.00           C  
HETATM   22  N   UNL     1       2.954   2.250  -1.345  1.00  0.00           N  
HETATM   23  C   UNL     1       3.633   1.954  -2.609  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.488  -2.065  -1.859  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.542  -1.759  -0.670  1.00  0.00           C  
HETATM   26  O   UNL     1      -1.339  -0.914   0.187  1.00  0.00           O  
HETATM   27  O   UNL     1      -1.124  -3.290  -2.498  1.00  0.00           O  
HETATM   28  C   UNL     1       0.705  -1.014  -1.151  1.00  0.00           C  
HETATM   29  N   UNL     1       1.637  -0.843  -0.029  1.00  0.00           N  
HETATM   30  H   UNL     1      -6.177   0.541   2.050  1.00  0.00           H  
HETATM   31  H   UNL     1      -4.436   2.536  -1.172  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.818   0.719  -1.352  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.802  -2.141   1.012  1.00  0.00           H  
HETATM   34  H   UNL     1       3.099  -0.416  -1.477  1.00  0.00           H  
HETATM   35  H   UNL     1       5.425  -0.595  -1.121  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.099  -3.244  -0.976  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.641  -1.722  -1.751  1.00  0.00           H  
HETATM   38  H   UNL     1       7.291  -1.182   0.375  1.00  0.00           H  
HETATM   39  H   UNL     1       6.904  -1.405   2.796  1.00  0.00           H  
HETATM   40  H   UNL     1       4.652  -1.041   3.722  1.00  0.00           H  
HETATM   41  H   UNL     1       2.788  -0.445   2.227  1.00  0.00           H  
HETATM   42  H   UNL     1       1.558   4.075   0.923  1.00  0.00           H  
HETATM   43  H   UNL     1       2.675   4.422  -1.427  1.00  0.00           H  
HETATM   44  H   UNL     1       2.891   1.750  -3.381  1.00  0.00           H  
HETATM   45  H   UNL     1       4.239   2.811  -2.905  1.00  0.00           H  
HETATM   46  H   UNL     1       4.274   1.082  -2.482  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.493  -1.242  -2.573  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.265  -2.678  -0.153  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.738  -3.570  -3.190  1.00  0.00           H  
HETATM   50  H   UNL     1       1.189  -1.589  -1.941  1.00  0.00           H  
HETATM   51  H   UNL     1       0.418  -0.036  -1.538  1.00  0.00           H  
HETATM   52  H   UNL     1       1.869  -1.732   0.388  1.00  0.00           H  
CONECT    1    2    8    9                                            
CONECT    2    1    3    3    4                                       
CONECT    3    2    2                                                 
CONECT    4    2    5   30                                            
CONECT    5    4    6    6    7                                       
CONECT    6    5    5                                                 
CONECT    7    5    8    8   31                                       
CONECT    8    1    7    7   32                                       
CONECT    9    1   13   26   33                                       
CONECT   10   11   18   29   34                                       
CONECT   11   10   12   12   17                                       
CONECT   12   11   11   14   35                                       
CONECT   13    9   24   36   37                                       
CONECT   14   12   15   15   38                                       
CONECT   15   14   14   16   39                                       
CONECT   16   15   17   17   40                                       
CONECT   17   11   16   16   41                                       
CONECT   18   10   19   19   22                                       
CONECT   19   18   18   20                                            
CONECT   20   19   21   21   42                                       
CONECT   21   20   20   22   43                                       
CONECT   22   18   21   23                                            
CONECT   23   22   44   45   46                                       
CONECT   24   13   25   27   47                                       
CONECT   25   24   26   28   48                                       
CONECT   26    9   25                                                 
CONECT   27   24   49                                                 
CONECT   28   25   29   50   51                                       
CONECT   29   10   28   52                                            
CONECT   30    4                                                      
CONECT   31    7                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   20                                                      
CONECT   43   21                                                      
CONECT   44   23                                                      
CONECT   45   23                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   27                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
