COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1       4.710  -0.460   2.610  1.00  0.00           C  
HETATM    2  C   UNL     1       5.127  -0.505   1.163  1.00  0.00           C  
HETATM    3  O   UNL     1       6.336  -0.830   0.684  1.00  0.00           O  
HETATM    4  N   UNL     1       6.370  -0.777  -0.523  1.00  0.00           N  
HETATM    5  C   UNL     1       5.227  -0.419  -1.027  1.00  0.00           C  
HETATM    6  C   UNL     1       4.896  -0.247  -2.487  1.00  0.00           C  
HETATM    7  C   UNL     1       4.347  -0.228   0.076  1.00  0.00           C  
HETATM    8  C   UNL     1       2.920   0.178   0.051  1.00  0.00           C  
HETATM    9  C   UNL     1       2.588   1.519   0.097  1.00  0.00           C  
HETATM   10  C   UNL     1       1.916  -0.804  -0.026  1.00  0.00           C  
HETATM   11  O   UNL     1       2.260  -2.118  -0.076  1.00  0.00           O  
HETATM   12  C   UNL     1       1.194  -3.066  -0.154  1.00  0.00           C  
HETATM   13  C   UNL     1       0.599  -0.448  -0.050  1.00  0.00           C  
HETATM   14  C   UNL     1       0.237   0.905   0.001  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.115   1.305  -0.023  1.00  0.00           C  
HETATM   16  C   UNL     1       1.240   1.904   0.074  1.00  0.00           C  
HETATM   17  N   UNL     1       0.899   3.200   0.123  1.00  0.00           N  
HETATM   18  C   UNL     1      -0.348   3.596   0.108  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.406   2.675   0.032  1.00  0.00           C  
HETATM   20  N   UNL     1      -2.756   2.792  -0.006  1.00  0.00           N  
HETATM   21  C   UNL     1      -3.294   1.608  -0.078  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.774   1.331  -0.138  1.00  0.00           C  
HETATM   23  N   UNL     1      -2.320   0.657  -0.091  1.00  0.00           N  
HETATM   24  C   UNL     1      -2.523  -0.792  -0.165  1.00  0.00           C  
HETATM   25  C   UNL     1      -2.096  -1.297  -1.545  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.980  -1.107   0.057  1.00  0.00           C  
HETATM   27  C   UNL     1      -4.849  -1.153  -1.017  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.185  -1.441  -0.813  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.652  -1.685   0.465  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.783  -1.640   1.539  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.446  -1.356   1.335  1.00  0.00           C  
HETATM   32  H   UNL     1       5.555  -0.737   3.241  1.00  0.00           H  
HETATM   33  H   UNL     1       4.384   0.549   2.863  1.00  0.00           H  
HETATM   34  H   UNL     1       3.890  -1.159   2.774  1.00  0.00           H  
HETATM   35  H   UNL     1       4.531  -1.192  -2.891  1.00  0.00           H  
HETATM   36  H   UNL     1       4.127   0.516  -2.598  1.00  0.00           H  
HETATM   37  H   UNL     1       5.792   0.058  -3.029  1.00  0.00           H  
HETATM   38  H   UNL     1       3.365   2.268   0.152  1.00  0.00           H  
HETATM   39  H   UNL     1       0.553  -2.964   0.722  1.00  0.00           H  
HETATM   40  H   UNL     1       0.609  -2.882  -1.055  1.00  0.00           H  
HETATM   41  H   UNL     1       1.606  -4.074  -0.188  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.165  -1.209  -0.109  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.568   4.653   0.150  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.069   1.155  -1.172  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.003   0.450   0.461  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.320   2.189   0.255  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.924  -1.282   0.603  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.068  -0.993  -1.741  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.166  -2.384  -1.571  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.752  -0.872  -2.305  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.484  -0.963  -2.015  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.864  -1.477  -1.652  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.696  -1.910   0.625  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.148  -1.830   2.538  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.766  -1.325   2.173  1.00  0.00           H  
CONECT    1    2   32   33   34                                       
CONECT    2    1    3    7    7                                       
CONECT    3    2    4                                                 
CONECT    4    3    5    5                                            
CONECT    5    7    4    4    6                                       
CONECT    6    5   35   36   37                                       
CONECT    7    2    2    8    5                                       
CONECT    8   10    7    9    9                                       
CONECT    9    8    8   16   38                                       
CONECT   10   11   13   13    8                                       
CONECT   11   12   10                                                 
CONECT   12   11   39   40   41                                       
CONECT   13   10   10   14   42                                       
CONECT   14   13   15   15   16                                       
CONECT   15   23   14   14   19                                       
CONECT   16   14    9   17   17                                       
CONECT   17   16   16   18                                            
CONECT   18   19   19   17   43                                       
CONECT   19   15   20   18   18                                       
CONECT   20   21   21   19                                            
CONECT   21   22   23   20   20                                       
CONECT   22   21   44   45   46                                       
CONECT   23   24   21   15                                            
CONECT   24   25   26   23   47                                       
CONECT   25   24   48   49   50                                       
CONECT   26   27   24   31   31                                       
CONECT   27   28   28   26   51                                       
CONECT   28   27   27   29   52                                       
CONECT   29   28   30   30   53                                       
CONECT   30   29   29   31   54                                       
CONECT   31   26   26   30   55                                       
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37    6                                                      
CONECT   38    9                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   18                                                      
CONECT   44   22                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   31                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
