COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -6.357   2.260   0.271  1.00  0.00           O  
HETATM    2  C   UNL     1      -6.889   1.177   0.124  1.00  0.00           C  
HETATM    3  N   UNL     1      -6.199   0.038  -0.022  1.00  0.00           N  
HETATM    4  C   UNL     1      -7.141  -1.081  -0.176  1.00  0.00           C  
HETATM    5  C   UNL     1      -8.526  -0.411  -0.097  1.00  0.00           C  
HETATM    6  N   UNL     1      -8.218   1.014   0.099  1.00  0.00           N  
HETATM    7  C   UNL     1      -4.803  -0.070  -0.027  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.205  -1.324  -0.072  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.832  -1.434  -0.077  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.040  -0.284  -0.036  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.645   0.975   0.010  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.019   1.077   0.009  1.00  0.00           C  
HETATM   13  C   UNL     1      -0.567  -0.398  -0.040  1.00  0.00           C  
HETATM   14  C   UNL     1       0.321   0.627  -0.004  1.00  0.00           C  
HETATM   15  N   UNL     1       1.555   0.096  -0.023  1.00  0.00           N  
HETATM   16  C   UNL     1       1.452  -1.211  -0.069  1.00  0.00           C  
HETATM   17  O   UNL     1       0.152  -1.544  -0.076  1.00  0.00           O  
HETATM   18  N   UNL     1       2.510  -2.099  -0.101  1.00  0.00           N  
HETATM   19  C   UNL     1       3.818  -1.635   0.062  1.00  0.00           C  
HETATM   20  C   UNL     1       4.892  -2.491  -0.147  1.00  0.00           C  
HETATM   21  C   UNL     1       4.648  -3.922  -0.549  1.00  0.00           C  
HETATM   22  C   UNL     1       6.183  -2.029   0.014  1.00  0.00           C  
HETATM   23  C   UNL     1       6.407  -0.715   0.384  1.00  0.00           C  
HETATM   24  C   UNL     1       5.341   0.140   0.592  1.00  0.00           C  
HETATM   25  C   UNL     1       4.047  -0.314   0.427  1.00  0.00           C  
HETATM   26  C   UNL     1       5.590   1.571   0.995  1.00  0.00           C  
HETATM   27  O   UNL     1       5.703   2.382  -0.175  1.00  0.00           O  
HETATM   28  C   UNL     1       5.942   3.765   0.097  1.00  0.00           C  
HETATM   29  C   UNL     1       6.045   4.534  -1.222  1.00  0.00           C  
HETATM   30  H   UNL     1      -7.004  -1.565  -1.144  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.015  -1.801   0.632  1.00  0.00           H  
HETATM   32  H   UNL     1      -9.082  -0.558  -1.023  1.00  0.00           H  
HETATM   33  H   UNL     1      -9.086  -0.802   0.752  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.873   1.723   0.190  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.818  -2.212  -0.104  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.367  -2.408  -0.112  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.036   1.866   0.042  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.488   2.050   0.039  1.00  0.00           H  
HETATM   39  H   UNL     1       0.080   1.679   0.034  1.00  0.00           H  
HETATM   40  H   UNL     1       2.344  -3.045  -0.237  1.00  0.00           H  
HETATM   41  H   UNL     1       4.615  -3.994  -1.637  1.00  0.00           H  
HETATM   42  H   UNL     1       5.454  -4.549  -0.168  1.00  0.00           H  
HETATM   43  H   UNL     1       3.698  -4.260  -0.134  1.00  0.00           H  
HETATM   44  H   UNL     1       7.018  -2.694  -0.147  1.00  0.00           H  
HETATM   45  H   UNL     1       7.418  -0.356   0.509  1.00  0.00           H  
HETATM   46  H   UNL     1       3.214   0.354   0.590  1.00  0.00           H  
HETATM   47  H   UNL     1       4.760   1.926   1.605  1.00  0.00           H  
HETATM   48  H   UNL     1       6.515   1.630   1.569  1.00  0.00           H  
HETATM   49  H   UNL     1       5.119   4.166   0.688  1.00  0.00           H  
HETATM   50  H   UNL     1       6.874   3.870   0.652  1.00  0.00           H  
HETATM   51  H   UNL     1       6.227   5.588  -1.014  1.00  0.00           H  
HETATM   52  H   UNL     1       6.868   4.133  -1.814  1.00  0.00           H  
HETATM   53  H   UNL     1       5.113   4.429  -1.778  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    6    3    1    1                                       
CONECT    3    4    2    7                                            
CONECT    4    5    3   30   31                                       
CONECT    5    6    4   32   33                                       
CONECT    6    5    2   34                                            
CONECT    7    3    8    8   12                                       
CONECT    8    7    7    9   35                                       
CONECT    9    8   10   10   36                                       
CONECT   10    9    9   11   13                                       
CONECT   11   12   12   10   37                                       
CONECT   12    7   11   11   38                                       
CONECT   13   10   17   14   14                                       
CONECT   14   13   13   15   39                                       
CONECT   15   16   16   14                                            
CONECT   16   17   18   15   15                                       
CONECT   17   13   16                                                 
CONECT   18   19   16   40                                            
CONECT   19   25   25   20   18                                       
CONECT   20   22   22   19   21                                       
CONECT   21   20   41   42   43                                       
CONECT   22   23   20   20   44                                       
CONECT   23   24   24   22   45                                       
CONECT   24   26   23   23   25                                       
CONECT   25   24   19   19   46                                       
CONECT   26   27   24   47   48                                       
CONECT   27   28   26                                                 
CONECT   28   29   27   49   50                                       
CONECT   29   28   51   52   53                                       
CONECT   30    4                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   14                                                      
CONECT   40   18                                                      
CONECT   41   21                                                      
CONECT   42   21                                                      
CONECT   43   21                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   26                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
