COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.438   1.803  -0.002  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.417   2.775  -0.850  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.751   2.891  -0.530  1.00  0.00           C  
HETATM    4  C   UNL     1       0.247   1.562  -0.644  1.00  0.00           C  
HETATM    5  C   UNL     1       1.677   1.435  -0.985  1.00  0.00           C  
HETATM    6  C   UNL     1       3.735   0.138  -1.124  1.00  0.00           C  
HETATM    7  C   UNL     1       4.592   0.408   0.094  1.00  0.00           C  
HETATM    8  C   UNL     1       4.496   1.398   1.057  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.618   0.874   0.155  1.00  0.00           C  
HETATM   10  C   UNL     1       3.108  -2.282  -0.878  1.00  0.00           C  
HETATM   11  C   UNL     1       4.061  -1.314  -1.533  1.00  0.00           C  
HETATM   12  C   UNL     1       5.492  -1.499  -0.987  1.00  0.00           C  
HETATM   13  C   UNL     1       5.601  -0.533   0.173  1.00  0.00           C  
HETATM   14  C   UNL     1       6.515  -0.480   1.219  1.00  0.00           C  
HETATM   15  C   UNL     1       6.414   0.514   2.180  1.00  0.00           C  
HETATM   16  C   UNL     1       5.403   1.452   2.097  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.728  -0.169   0.499  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.205  -1.436   0.724  1.00  0.00           C  
HETATM   19  C   UNL     1      -7.028  -2.543   0.661  1.00  0.00           C  
HETATM   20  C   UNL     1      -8.372  -2.392   0.373  1.00  0.00           C  
HETATM   21  C   UNL     1      -8.896  -1.133   0.148  1.00  0.00           C  
HETATM   22  C   UNL     1      -8.079  -0.021   0.210  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.779   0.596   0.210  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.445   0.473  -0.108  1.00  0.00           C  
HETATM   25  N   UNL     1       2.316   0.265  -0.785  1.00  0.00           N  
HETATM   26  N   UNL     1      -3.789   1.923   0.321  1.00  0.00           N  
HETATM   27  N   UNL     1      -5.898   0.955   0.568  1.00  0.00           N  
HETATM   28  O   UNL     1       2.014  -2.695  -1.537  1.00  0.00           O  
HETATM   29  O   UNL     1       7.508  -1.404   1.299  1.00  0.00           O  
HETATM   30  O   UNL     1      -4.211  -0.145  -0.368  1.00  0.00           O  
HETATM   31  O   UNL     1       2.279   2.385  -1.447  1.00  0.00           O  
HETATM   32  O   UNL     1       3.329  -2.684   0.239  1.00  0.00           O  
HETATM   33  H   UNL     1       0.116   3.620  -1.260  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.264   3.827  -0.690  1.00  0.00           H  
HETATM   35  H   UNL     1       3.994   0.825  -1.930  1.00  0.00           H  
HETATM   36  H   UNL     1       3.707   2.134   0.994  1.00  0.00           H  
HETATM   37  H   UNL     1       4.042  -1.425  -2.617  1.00  0.00           H  
HETATM   38  H   UNL     1       5.635  -2.523  -0.640  1.00  0.00           H  
HETATM   39  H   UNL     1       6.225  -1.255  -1.755  1.00  0.00           H  
HETATM   40  H   UNL     1       7.124   0.554   2.993  1.00  0.00           H  
HETATM   41  H   UNL     1       5.323   2.227   2.845  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.155  -1.554   0.949  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.621  -3.528   0.836  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.013  -3.260   0.324  1.00  0.00           H  
HETATM   45  H   UNL     1      -9.946  -1.018  -0.077  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.489   0.962   0.035  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.314  -0.246   0.624  1.00  0.00           H  
HETATM   48  H   UNL     1       0.065  -0.466   0.053  1.00  0.00           H  
HETATM   49  H   UNL     1       1.835  -0.493  -0.417  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.132   2.763   0.666  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.245   1.793   0.913  1.00  0.00           H  
HETATM   52  H   UNL     1       1.433  -3.316  -1.076  1.00  0.00           H  
HETATM   53  H   UNL     1       8.319  -1.150   0.838  1.00  0.00           H  
CONECT    1    3    3   23   26                                       
CONECT    2    4    4    3   33                                       
CONECT    3    2    1    1   34                                       
CONECT    4    5    2    2   24                                       
CONECT    5   31   31   25    4                                       
CONECT    6    7   11   25   35                                       
CONECT    7    8    8   13    6                                       
CONECT    8   16    7    7   36                                       
CONECT    9   30   30   26   27                                       
CONECT   10   11   32   32   28                                       
CONECT   11    6   12   10   37                                       
CONECT   12   13   11   38   39                                       
CONECT   13   14   14    7   12                                       
CONECT   14   15   29   13   13                                       
CONECT   15   16   16   14   40                                       
CONECT   16   15   15    8   41                                       
CONECT   17   27   18   18   22                                       
CONECT   18   17   17   19   42                                       
CONECT   19   18   20   20   43                                       
CONECT   20   19   19   21   44                                       
CONECT   21   22   22   20   45                                       
CONECT   22   17   21   21   46                                       
CONECT   23   24   24    1   47                                       
CONECT   24    4   23   23   48                                       
CONECT   25    6    5   49                                            
CONECT   26    1    9   50                                            
CONECT   27    9   17   51                                            
CONECT   28   10   52                                                 
CONECT   29   14   53                                                 
CONECT   30    9    9                                                 
CONECT   31    5    5                                                 
CONECT   32   10   10                                                 
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    6                                                      
CONECT   36    8                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   21                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   28                                                      
CONECT   53   29                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
