COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.417   0.363   0.982  1.00  0.00           C  
HETATM    2  C   UNL     1       5.021   0.278   0.962  1.00  0.00           C  
HETATM    3  C   UNL     1       5.683   0.412   3.084  1.00  0.00           C  
HETATM    4  C   UNL     1       4.342   0.179  -0.337  1.00  0.00           C  
HETATM    5  C   UNL     1       2.867   0.086  -0.413  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.319  -0.304  -0.555  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.299  -1.485   0.036  1.00  0.00           C  
HETATM    8  N   UNL     1       6.798   0.445   2.302  1.00  0.00           N  
HETATM    9  C   UNL     1       7.117   0.346  -0.240  1.00  0.00           C  
HETATM   10  O   UNL     1       8.334   0.419  -0.240  1.00  0.00           O  
HETATM   11  C   UNL     1      -4.064  -0.331   0.065  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.453  -0.420   0.124  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.275   0.814   0.155  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.661   2.065   0.118  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.431   3.210   0.146  1.00  0.00           C  
HETATM   16  C   UNL     1      -7.810   3.118   0.211  1.00  0.00           C  
HETATM   17  C   UNL     1      -8.425   1.879   0.248  1.00  0.00           C  
HETATM   18  C   UNL     1      -7.665   0.728   0.215  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.070  -1.670   0.155  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.306  -2.819   0.127  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.922  -2.734   0.067  1.00  0.00           C  
HETATM   22  C   UNL     1       0.748   0.979  -1.060  1.00  0.00           C  
HETATM   23  C   UNL     1       2.122   1.109  -1.012  1.00  0.00           C  
HETATM   24  C   UNL     1       5.098   0.174  -1.469  1.00  0.00           C  
HETATM   25  C   UNL     1       7.222   0.240  -2.655  1.00  0.00           C  
HETATM   26  C   UNL     1       4.589   0.311   2.301  1.00  0.00           C  
HETATM   27  C   UNL     1       2.199  -1.026   0.107  1.00  0.00           C  
HETATM   28  C   UNL     1       0.152  -0.159  -0.514  1.00  0.00           C  
HETATM   29  N   UNL     1       0.890  -1.113   0.043  1.00  0.00           N  
HETATM   30  N   UNL     1      -1.903  -1.400  -0.030  1.00  0.00           N  
HETATM   31  N   UNL     1      -3.151  -3.900   0.037  1.00  0.00           N  
HETATM   32  N   UNL     1       6.455   0.249  -1.406  1.00  0.00           N  
HETATM   33  O   UNL     1      -2.001   0.565  -1.062  1.00  0.00           O  
HETATM   34  H   UNL     1       5.677   0.460   4.163  1.00  0.00           H  
HETATM   35  H   UNL     1       7.710   0.515   2.623  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.584   0.636   0.041  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.585   2.137   0.068  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.956   4.179   0.117  1.00  0.00           H  
HETATM   39  H   UNL     1      -8.408   4.016   0.234  1.00  0.00           H  
HETATM   40  H   UNL     1      -9.501   1.813   0.299  1.00  0.00           H  
HETATM   41  H   UNL     1      -8.146  -0.239   0.239  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.147  -1.739   0.201  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.786  -3.786   0.151  1.00  0.00           H  
HETATM   44  H   UNL     1       0.141   1.750  -1.510  1.00  0.00           H  
HETATM   45  H   UNL     1       2.611   1.978  -1.427  1.00  0.00           H  
HETATM   46  H   UNL     1       4.613   0.102  -2.432  1.00  0.00           H  
HETATM   47  H   UNL     1       7.357   1.263  -3.005  1.00  0.00           H  
HETATM   48  H   UNL     1       8.196  -0.216  -2.479  1.00  0.00           H  
HETATM   49  H   UNL     1       6.682  -0.334  -3.408  1.00  0.00           H  
HETATM   50  H   UNL     1       3.565   0.265   2.642  1.00  0.00           H  
HETATM   51  H   UNL     1       2.765  -1.823   0.567  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.356  -2.129   0.302  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.184  -3.841  -0.005  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.584  -4.768   0.059  1.00  0.00           H  
CONECT    1    9    2    2    8                                       
CONECT    2    4    1    1   26                                       
CONECT    3    8   26   26   34                                       
CONECT    4   24   24    5    2                                       
CONECT    5   23    4   27   27                                       
CONECT    6   33   33   28   30                                       
CONECT    7   30   21   21   11                                       
CONECT    8    1    3   35                                            
CONECT    9   32   10   10    1                                       
CONECT   10    9    9                                                 
CONECT   11    7   12   12   36                                       
CONECT   12   11   11   19   13                                       
CONECT   13   12   18   18   14                                       
CONECT   14   13   15   15   37                                       
CONECT   15   14   14   16   38                                       
CONECT   16   17   17   15   39                                       
CONECT   17   18   16   16   40                                       
CONECT   18   13   13   17   41                                       
CONECT   19   20   20   12   42                                       
CONECT   20   21   19   19   43                                       
CONECT   21   31    7    7   20                                       
CONECT   22   23   23   28   44                                       
CONECT   23   22   22    5   45                                       
CONECT   24   32    4    4   46                                       
CONECT   25   32   47   48   49                                       
CONECT   26    2    3    3   50                                       
CONECT   27    5    5   29   51                                       
CONECT   28   22    6   29   29                                       
CONECT   29   28   28   27                                            
CONECT   30    6    7   52                                            
CONECT   31   21   53   54                                            
CONECT   32   25   24    9                                            
CONECT   33    6    6                                                 
CONECT   34    3                                                      
CONECT   35    8                                                      
CONECT   36   11                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   24                                                      
CONECT   47   25                                                      
CONECT   48   25                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   30                                                      
CONECT   53   31                                                      
CONECT   54   31                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
