COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.040  -2.003   0.165  1.00  0.00           N  
HETATM    2  C   UNL     1      -1.395  -1.797  -0.114  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.971  -0.559   0.127  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.322  -0.359  -0.153  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.085  -1.405  -0.673  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.503  -2.633  -0.909  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.162  -2.831  -0.637  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.382   2.552   0.470  1.00  0.00           C  
HETATM    9  N   UNL     1      -4.173   3.046   0.436  1.00  0.00           N  
HETATM   10  N   UNL     1      -3.320   2.110   0.219  1.00  0.00           N  
HETATM   11  C   UNL     1      -3.945   0.959   0.102  1.00  0.00           C  
HETATM   12  N   UNL     1      -5.280   1.211   0.265  1.00  0.00           N  
HETATM   13  C   UNL     1       0.847  -1.006  -0.026  1.00  0.00           C  
HETATM   14  C   UNL     1       2.293  -1.251   0.184  1.00  0.00           C  
HETATM   15  N   UNL     1       2.708  -2.454   0.560  1.00  0.00           N  
HETATM   16  C   UNL     1       3.203  -0.218  -0.021  1.00  0.00           C  
HETATM   17  C   UNL     1       4.563  -0.466   0.181  1.00  0.00           C  
HETATM   18  C   UNL     1       4.949  -1.747   0.583  1.00  0.00           C  
HETATM   19  C   UNL     1       3.981  -2.720   0.759  1.00  0.00           C  
HETATM   20  O   UNL     1       0.460   0.093  -0.370  1.00  0.00           O  
HETATM   21  C   UNL     1      -6.374   0.237   0.226  1.00  0.00           C  
HETATM   22  C   UNL     1       5.570   0.603  -0.025  1.00  0.00           C  
HETATM   23  C   UNL     1       5.177   1.879  -0.425  1.00  0.00           C  
HETATM   24  N   UNL     1       6.071   2.829  -0.608  1.00  0.00           N  
HETATM   25  C   UNL     1       7.360   2.618  -0.423  1.00  0.00           C  
HETATM   26  C   UNL     1       7.829   1.379  -0.026  1.00  0.00           C  
HETATM   27  C   UNL     1       6.929   0.349   0.185  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.749   0.700   0.712  1.00  0.00           C  
HETATM   29  C   UNL     1      -7.500   0.481  -0.782  1.00  0.00           C  
HETATM   30  H   UNL     1       0.262  -2.863   0.499  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.376   0.247   0.530  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.132  -1.253  -0.890  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.095  -3.442  -1.311  1.00  0.00           H  
HETATM   34  H   UNL     1      -1.710  -3.793  -0.827  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.294   3.106   0.636  1.00  0.00           H  
HETATM   36  H   UNL     1       2.863   0.759  -0.332  1.00  0.00           H  
HETATM   37  H   UNL     1       5.991  -1.977   0.749  1.00  0.00           H  
HETATM   38  H   UNL     1       4.275  -3.712   1.069  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.091  -0.796   0.424  1.00  0.00           H  
HETATM   40  H   UNL     1       4.131   2.090  -0.587  1.00  0.00           H  
HETATM   41  H   UNL     1       8.059   3.424  -0.585  1.00  0.00           H  
HETATM   42  H   UNL     1       8.887   1.218   0.123  1.00  0.00           H  
HETATM   43  H   UNL     1       7.267  -0.628   0.496  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.371  -0.030   1.231  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.840   1.728   1.062  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.426   1.365  -1.415  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.958  -0.393  -1.246  1.00  0.00           H  
CONECT    1   13    2   30                                            
CONECT    2    7    7    1    3                                       
CONECT    3    2    4    4   31                                       
CONECT    4    3    3    5   11                                       
CONECT    5    6    6    4   32                                       
CONECT    6    7    5    5   33                                       
CONECT    7    2    2    6   34                                       
CONECT    8   12    9    9   35                                       
CONECT    9   10    8    8                                            
CONECT   10   11   11    9                                            
CONECT   11    4   10   10   12                                       
CONECT   12   11   21    8                                            
CONECT   13   20   20   14    1                                       
CONECT   14   16   13   15   15                                       
CONECT   15   14   14   19                                            
CONECT   16   17   17   14   36                                       
CONECT   17   22   16   16   18                                       
CONECT   18   17   19   19   37                                       
CONECT   19   18   18   15   38                                       
CONECT   20   13   13                                                 
CONECT   21   28   12   29   39                                       
CONECT   22   23   23   27   17                                       
CONECT   23   24   22   22   40                                       
CONECT   24   25   25   23                                            
CONECT   25   24   24   26   41                                       
CONECT   26   25   27   27   42                                       
CONECT   27   26   26   22   43                                       
CONECT   28   21   29   44   45                                       
CONECT   29   28   21   46   47                                       
CONECT   30    1                                                      
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   16                                                      
CONECT   37   18                                                      
CONECT   38   19                                                      
CONECT   39   21                                                      
CONECT   40   23                                                      
CONECT   41   25                                                      
CONECT   42   26                                                      
CONECT   43   27                                                      
CONECT   44   28                                                      
CONECT   45   28                                                      
CONECT   46   29                                                      
CONECT   47   29                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
