COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.508  -0.479   1.606  1.00  0.00           N  
HETATM    2  C   UNL     1      -5.903  -1.461   0.826  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.672  -1.599   0.213  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.842  -0.498   0.069  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.276  -1.938  -0.995  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.932  -1.874  -1.722  1.00  0.00           C  
HETATM    7  C   UNL     1       2.463  -1.007  -0.239  1.00  0.00           C  
HETATM    8  C   UNL     1       3.940   0.592   0.947  1.00  0.00           C  
HETATM    9  C   UNL     1       3.796   2.948   0.522  1.00  0.00           C  
HETATM   10  C   UNL     1       2.327   1.455  -0.654  1.00  0.00           C  
HETATM   11  O   UNL     1       4.624  -2.655   1.977  1.00  0.00           O  
HETATM   12  C   UNL     1       4.097  -1.737   1.374  1.00  0.00           C  
HETATM   13  C   UNL     1       3.067  -2.023   0.447  1.00  0.00           C  
HETATM   14  C   UNL     1       2.907   0.370   0.018  1.00  0.00           C  
HETATM   15  O   UNL     1       1.329   1.250  -1.551  1.00  0.00           O  
HETATM   16  C   UNL     1       0.863   2.391  -2.275  1.00  0.00           C  
HETATM   17  C   UNL     1       2.778   2.737  -0.394  1.00  0.00           C  
HETATM   18  C   UNL     1       4.376   1.890   1.190  1.00  0.00           C  
HETATM   19  C   UNL     1       1.377  -1.286  -1.211  1.00  0.00           C  
HETATM   20  O   UNL     1       1.621  -1.321  -2.400  1.00  0.00           O  
HETATM   21  N   UNL     1       0.120  -1.500  -0.773  1.00  0.00           N  
HETATM   22  O   UNL     1      -2.630  -0.632  -0.533  1.00  0.00           O  
HETATM   23  C   UNL     1      -4.252   0.744   0.542  1.00  0.00           C  
HETATM   24  O   UNL     1      -3.442   1.828   0.403  1.00  0.00           O  
HETATM   25  C   UNL     1      -3.928   3.071   0.912  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.311  -0.226   1.296  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.488   0.876   1.155  1.00  0.00           C  
HETATM   28  H   UNL     1       5.220  -0.321   2.246  1.00  0.00           H  
HETATM   29  H   UNL     1      -6.551  -2.319   0.933  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.356  -2.565  -0.153  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.043  -2.302  -1.679  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.197  -2.614  -0.144  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.704  -2.849  -2.152  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.984  -1.130  -2.518  1.00  0.00           H  
HETATM   35  H   UNL     1       4.140   3.954   0.715  1.00  0.00           H  
HETATM   36  H   UNL     1       2.757  -3.044   0.281  1.00  0.00           H  
HETATM   37  H   UNL     1       1.674   2.790  -2.885  1.00  0.00           H  
HETATM   38  H   UNL     1       0.034   2.098  -2.919  1.00  0.00           H  
HETATM   39  H   UNL     1       0.526   3.154  -1.573  1.00  0.00           H  
HETATM   40  H   UNL     1       2.335   3.577  -0.908  1.00  0.00           H  
HETATM   41  H   UNL     1       5.168   2.069   1.902  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.088  -1.408   0.169  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.857   3.333   0.406  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.112   2.979   1.983  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.186   3.851   0.737  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.275  -0.122   1.769  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.808   1.839   1.523  1.00  0.00           H  
CONECT    1   12    8   28                                            
CONECT    2    3    3   26   29                                       
CONECT    3    2    2    4   30                                       
CONECT    4    3   22   23   23                                       
CONECT    5    6   22   31   32                                       
CONECT    6   21    5   33   34                                       
CONECT    7   13   13   14   19                                       
CONECT    8    1   18   18   14                                       
CONECT    9   18   17   17   35                                       
CONECT   10   14   14   17   15                                       
CONECT   11   12   12                                                 
CONECT   12   11   11    1   13                                       
CONECT   13   12    7    7   36                                       
CONECT   14    8    7   10   10                                       
CONECT   15   10   16                                                 
CONECT   16   15   37   38   39                                       
CONECT   17    9    9   10   40                                       
CONECT   18    8    8    9   41                                       
CONECT   19    7   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   19    6   42                                            
CONECT   22    5    4                                                 
CONECT   23    4    4   27   24                                       
CONECT   24   23   25                                                 
CONECT   25   24   43   44   45                                       
CONECT   26    2   27   27   46                                       
CONECT   27   26   26   23   47                                       
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    9                                                      
CONECT   36   13                                                      
CONECT   37   16                                                      
CONECT   38   16                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   21                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
CONECT   47   27                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
