COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       0.062  -2.891   0.784  1.00  0.00           N  
HETATM    2  N   UNL     1      -3.543  -1.037   0.986  1.00  0.00           N  
HETATM    3  C   UNL     1      -0.114  -1.673   0.280  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.933  -3.537   1.367  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.416  -1.814   1.013  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.272   0.162   0.361  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.246   1.251   0.148  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.494   2.699  -0.651  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.970   0.185  -0.027  1.00  0.00           C  
HETATM   10  C   UNL     1       3.303  -0.659   0.041  1.00  0.00           C  
HETATM   11  C   UNL     1       4.995  -0.038   1.607  1.00  0.00           C  
HETATM   12  C   UNL     1       5.316   3.533  -0.416  1.00  0.00           C  
HETATM   13  C   UNL     1       6.563   2.971   0.281  1.00  0.00           C  
HETATM   14  N   UNL     1      -6.827  -1.104  -0.631  1.00  0.00           N  
HETATM   15  C   UNL     1      -6.278  -0.126  -0.446  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.586   1.105  -0.212  1.00  0.00           C  
HETATM   17  N   UNL     1      -6.111   2.365  -0.300  1.00  0.00           N  
HETATM   18  N   UNL     1      -5.097   3.280   0.006  1.00  0.00           N  
HETATM   19  C   UNL     1      -3.997   2.630   0.276  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.387  -1.087   0.382  1.00  0.00           C  
HETATM   21  N   UNL     1      -2.140  -3.028   1.485  1.00  0.00           N  
HETATM   22  N   UNL     1       0.929  -1.001  -0.329  1.00  0.00           N  
HETATM   23  C   UNL     1       2.249  -1.629  -0.425  1.00  0.00           C  
HETATM   24  C   UNL     1       2.523  -2.021  -1.879  1.00  0.00           C  
HETATM   25  C   UNL     1       3.866  -2.749  -1.967  1.00  0.00           C  
HETATM   26  C   UNL     1       1.409  -2.944  -2.377  1.00  0.00           C  
HETATM   27  N   UNL     1       3.521   0.445  -0.649  1.00  0.00           N  
HETATM   28  C   UNL     1       4.435   1.329  -0.282  1.00  0.00           C  
HETATM   29  O   UNL     1       4.619   2.447  -1.035  1.00  0.00           O  
HETATM   30  O   UNL     1       6.141   2.013   1.255  1.00  0.00           O  
HETATM   31  C   UNL     1       5.199   1.114   0.861  1.00  0.00           C  
HETATM   32  C   UNL     1       4.023  -0.934   1.186  1.00  0.00           C  
HETATM   33  H   UNL     1      -4.404  -1.292   1.353  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.747  -4.525   1.762  1.00  0.00           H  
HETATM   35  H   UNL     1      -8.099   2.741   0.254  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.518   3.668  -1.150  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.892   1.936  -1.320  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.465   0.990  -0.541  1.00  0.00           H  
HETATM   39  H   UNL     1       5.576  -0.230   2.497  1.00  0.00           H  
HETATM   40  H   UNL     1       4.670   4.013   0.319  1.00  0.00           H  
HETATM   41  H   UNL     1       5.613   4.258  -1.173  1.00  0.00           H  
HETATM   42  H   UNL     1       7.207   2.486  -0.453  1.00  0.00           H  
HETATM   43  H   UNL     1       7.107   3.780   0.769  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.052   3.076   0.550  1.00  0.00           H  
HETATM   45  H   UNL     1       0.788  -0.112  -0.692  1.00  0.00           H  
HETATM   46  H   UNL     1       2.273  -2.521   0.202  1.00  0.00           H  
HETATM   47  H   UNL     1       2.555  -1.123  -2.497  1.00  0.00           H  
HETATM   48  H   UNL     1       3.860  -3.603  -1.291  1.00  0.00           H  
HETATM   49  H   UNL     1       4.025  -3.094  -2.988  1.00  0.00           H  
HETATM   50  H   UNL     1       4.668  -2.067  -1.684  1.00  0.00           H  
HETATM   51  H   UNL     1       0.452  -2.425  -2.314  1.00  0.00           H  
HETATM   52  H   UNL     1       1.604  -3.222  -3.412  1.00  0.00           H  
HETATM   53  H   UNL     1       1.377  -3.841  -1.759  1.00  0.00           H  
HETATM   54  H   UNL     1       3.834  -1.839   1.745  1.00  0.00           H  
CONECT    1    3    3    4                                            
CONECT    2    5    6   33                                            
CONECT    3   22    1    1   20                                       
CONECT    4    1   21   21   34                                       
CONECT    5   21    2   20   20                                       
CONECT    6    2    7    9    9                                       
CONECT    7    6   19   16   16                                       
CONECT    8   17   35   36   37                                       
CONECT    9    6    6   20   38                                       
CONECT   10   23   32   32   27                                       
CONECT   11   32   31   31   39                                       
CONECT   12   29   13   40   41                                       
CONECT   13   12   30   42   43                                       
CONECT   14   15   15   15                                            
CONECT   15   16   14   14   14                                       
CONECT   16   17    7    7   15                                       
CONECT   17   18    8   16                                            
CONECT   18   19   19   17                                            
CONECT   19    7   18   18   44                                       
CONECT   20    9    3    5    5                                       
CONECT   21    4    4    5                                            
CONECT   22   23    3   45                                            
CONECT   23   24   22   10   46                                       
CONECT   24   26   25   23   47                                       
CONECT   25   24   48   49   50                                       
CONECT   26   24   51   52   53                                       
CONECT   27   28   28   10                                            
CONECT   28   31   27   27   29                                       
CONECT   29   28   12                                                 
CONECT   30   13   31                                                 
CONECT   31   11   11   28   30                                       
CONECT   32   10   10   11   54                                       
CONECT   33    2                                                      
CONECT   34    4                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   13                                                      
CONECT   44   19                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   26                                                      
CONECT   54   32                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
