COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.073  -1.383   0.109  1.00  0.00           C  
HETATM    2  C   UNL     1       5.653  -1.707  -1.104  1.00  0.00           C  
HETATM    3  C   UNL     1       7.026  -1.829  -1.203  1.00  0.00           C  
HETATM    4  C   UNL     1       7.820  -1.625  -0.090  1.00  0.00           C  
HETATM    5  C   UNL     1       7.241  -1.300   1.122  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.817  -0.633   0.369  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.778  -1.475  -0.179  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.100  -1.093  -0.186  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.492   0.128   0.349  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.525   0.969   0.897  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.200   0.589   0.906  1.00  0.00           C  
HETATM   12  C   UNL     1       3.576  -1.257   0.219  1.00  0.00           C  
HETATM   13  C   UNL     1       1.451   1.836  -0.153  1.00  0.00           C  
HETATM   14  C   UNL     1       0.092   2.151  -0.104  1.00  0.00           C  
HETATM   15  N   UNL     1      -0.811   1.210   0.069  1.00  0.00           N  
HETATM   16  C   UNL     1      -0.477  -0.069   0.205  1.00  0.00           C  
HETATM   17  C   UNL     1       0.852  -0.470   0.168  1.00  0.00           C  
HETATM   18  C   UNL     1       1.843   0.487  -0.013  1.00  0.00           C  
HETATM   19  N   UNL     1       3.181   0.127  -0.055  1.00  0.00           N  
HETATM   20  N   UNL     1      -1.471  -1.018   0.385  1.00  0.00           N  
HETATM   21  C   UNL     1       2.457   2.891  -0.353  1.00  0.00           C  
HETATM   22  N   UNL     1       2.083   4.186  -0.363  1.00  0.00           N  
HETATM   23  O   UNL     1       3.626   2.595  -0.510  1.00  0.00           O  
HETATM   24  C   UNL     1       5.867  -1.180   1.222  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.358  -1.759  -0.693  1.00  0.00           C  
HETATM   26  C   UNL     1      -7.456  -0.768  -0.372  1.00  0.00           C  
HETATM   27  N   UNL     1      -6.875   0.287   0.225  1.00  0.00           N  
HETATM   28  O   UNL     1      -8.638  -0.900  -0.609  1.00  0.00           O  
HETATM   29  H   UNL     1       5.032  -1.866  -1.973  1.00  0.00           H  
HETATM   30  H   UNL     1       7.479  -2.083  -2.150  1.00  0.00           H  
HETATM   31  H   UNL     1       8.893  -1.720  -0.167  1.00  0.00           H  
HETATM   32  H   UNL     1       7.861  -1.141   1.992  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.487  -2.427  -0.599  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.816   1.920   1.317  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.456   1.245   1.334  1.00  0.00           H  
HETATM   36  H   UNL     1       3.101  -1.920  -0.505  1.00  0.00           H  
HETATM   37  H   UNL     1       3.260  -1.532   1.225  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.222   3.179  -0.209  1.00  0.00           H  
HETATM   39  H   UNL     1       1.112  -1.512   0.279  1.00  0.00           H  
HETATM   40  H   UNL     1       3.855   0.791  -0.266  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.235  -1.948   0.522  1.00  0.00           H  
HETATM   42  H   UNL     1       1.151   4.422  -0.238  1.00  0.00           H  
HETATM   43  H   UNL     1       2.746   4.881  -0.495  1.00  0.00           H  
HETATM   44  H   UNL     1       5.415  -0.927   2.169  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.296  -1.925  -1.769  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.529  -2.700  -0.170  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.359   1.068   0.534  1.00  0.00           H  
CONECT    1   12    2    2   24                                       
CONECT    2    1    1    3   29                                       
CONECT    3    2    4    4   30                                       
CONECT    4    3    3    5   31                                       
CONECT    5   24   24    4   32                                       
CONECT    6   20   11   11    7                                       
CONECT    7    6    8    8   33                                       
CONECT    8    7    7    9   25                                       
CONECT    9   10   10    8   27                                       
CONECT   10   11    9    9   34                                       
CONECT   11    6    6   10   35                                       
CONECT   12   19    1   36   37                                       
CONECT   13   14   21   18   18                                       
CONECT   14   15   15   13   38                                       
CONECT   15   14   14   16                                            
CONECT   16   15   20   17   17                                       
CONECT   17   16   16   18   39                                       
CONECT   18   13   13   17   19                                       
CONECT   19   18   12   40                                            
CONECT   20   16    6   41                                            
CONECT   21   22   13   23   23                                       
CONECT   22   21   42   43                                            
CONECT   23   21   21                                                 
CONECT   24    1    5    5   44                                       
CONECT   25    8   26   45   46                                       
CONECT   26   27   25   28   28                                       
CONECT   27    9   26   47                                            
CONECT   28   26   26                                                 
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   14                                                      
CONECT   39   17                                                      
CONECT   40   19                                                      
CONECT   41   20                                                      
CONECT   42   22                                                      
CONECT   43   22                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   25                                                      
CONECT   47   27                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
