COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.747  -1.315   0.439  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.211   0.738  -0.010  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.025   0.054   0.303  1.00  0.00           C  
HETATM    4  N   UNL     1       5.174  -1.508  -1.035  1.00  0.00           N  
HETATM    5  C   UNL     1      -2.682   0.437   0.368  1.00  0.00           C  
HETATM    6  C   UNL     1       0.547  -0.836   0.029  1.00  0.00           C  
HETATM    7  C   UNL     1       0.997  -2.417  -1.585  1.00  0.00           C  
HETATM    8  C   UNL     1       2.349  -2.160  -1.450  1.00  0.00           C  
HETATM    9  C   UNL     1       2.754  -1.201  -0.523  1.00  0.00           C  
HETATM   10  C   UNL     1       4.629  -0.004   0.518  1.00  0.00           C  
HETATM   11  C   UNL     1       5.974  -0.030   0.379  1.00  0.00           C  
HETATM   12  C   UNL     1       6.289  -0.980  -0.600  1.00  0.00           C  
HETATM   13  C   UNL     1       6.960   0.816   1.143  1.00  0.00           C  
HETATM   14  C   UNL     1       7.964   3.017   1.234  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.656   4.042  -1.014  1.00  0.00           C  
HETATM   16  O   UNL     1      -4.332   2.806  -0.425  1.00  0.00           O  
HETATM   17  C   UNL     1      -5.326   2.105  -0.368  1.00  0.00           C  
HETATM   18  N   UNL     1      -6.537   2.629  -0.644  1.00  0.00           N  
HETATM   19  N   UNL     1      -6.220  -0.153   0.093  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.733  -0.504   0.719  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.143  -1.824   1.002  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.446  -2.162   0.933  1.00  0.00           C  
HETATM   23  N   UNL     1      -4.391  -1.239   0.585  1.00  0.00           N  
HETATM   24  C   UNL     1      -6.572  -2.557   0.652  1.00  0.00           C  
HETATM   25  N   UNL     1      -0.388  -0.155   0.791  1.00  0.00           N  
HETATM   26  N   UNL     1       1.833  -0.565   0.192  1.00  0.00           N  
HETATM   27  N   UNL     1       0.133  -1.746  -0.840  1.00  0.00           N  
HETATM   28  N   UNL     1       4.109  -0.913  -0.349  1.00  0.00           N  
HETATM   29  N   UNL     1       7.199   2.069   0.414  1.00  0.00           N  
HETATM   30  C   UNL     1       7.874   1.813  -0.865  1.00  0.00           C  
HETATM   31  H   UNL     1      -2.391   1.453   0.147  1.00  0.00           H  
HETATM   32  H   UNL     1       0.650  -3.157  -2.291  1.00  0.00           H  
HETATM   33  H   UNL     1       3.075  -2.694  -2.046  1.00  0.00           H  
HETATM   34  H   UNL     1       4.070   0.625   1.195  1.00  0.00           H  
HETATM   35  H   UNL     1       7.283  -1.234  -0.937  1.00  0.00           H  
HETATM   36  H   UNL     1       6.558   1.041   2.131  1.00  0.00           H  
HETATM   37  H   UNL     1       7.899   0.272   1.249  1.00  0.00           H  
HETATM   38  H   UNL     1       8.927   2.576   1.496  1.00  0.00           H  
HETATM   39  H   UNL     1       8.127   3.936   0.670  1.00  0.00           H  
HETATM   40  H   UNL     1       7.408   3.242   2.144  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.703   4.281  -1.199  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.280   4.663  -0.201  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.075   4.232  -1.916  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.329   2.071  -0.599  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.410  -2.568   1.276  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.746  -3.176   1.152  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.892  -2.607   1.693  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.448  -2.527   0.004  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.974  -3.437   0.414  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.106   0.566   1.376  1.00  0.00           H  
HETATM   51  H   UNL     1       7.253   1.163  -1.481  1.00  0.00           H  
HETATM   52  H   UNL     1       8.039   2.758  -1.384  1.00  0.00           H  
HETATM   53  H   UNL     1       8.833   1.329  -0.679  1.00  0.00           H  
CONECT    1   19   19   24   23                                       
CONECT    2   17   19    3    3                                       
CONECT    3    2    2   23    5                                       
CONECT    4   12   12   28                                            
CONECT    5    3   20   20   31                                       
CONECT    6   26   25   27   27                                       
CONECT    7    8    8   27   32                                       
CONECT    8    9    7    7   33                                       
CONECT    9   28   26   26    8                                       
CONECT   10   11   11   28   34                                       
CONECT   11   13   12   10   10                                       
CONECT   12   11    4    4   35                                       
CONECT   13   11   29   36   37                                       
CONECT   14   29   38   39   40                                       
CONECT   15   18   41   42   43                                       
CONECT   16   17   17                                                 
CONECT   17   18   16   16    2                                       
CONECT   18   15   17   44                                            
CONECT   19    2    1    1                                            
CONECT   20    5    5   21   25                                       
CONECT   21   22   22   20   45                                       
CONECT   22   23   21   21   46                                       
CONECT   23    1    3   22                                            
CONECT   24    1   47   48   49                                       
CONECT   25   20    6   50                                            
CONECT   26    9    9    6                                            
CONECT   27    6    6    7                                            
CONECT   28   10    4    9                                            
CONECT   29   14   13   30                                            
CONECT   30   29   51   52   53                                       
CONECT   31    5                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   14                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   15                                                      
CONECT   44   18                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   24                                                      
CONECT   48   24                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   30                                                      
CONECT   52   30                                                      
CONECT   53   30                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
