COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.798   1.200   0.069  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.312  -0.242  -0.701  1.00  0.00           C  
HETATM    3  C   UNL     1       6.248   1.704   0.117  1.00  0.00           C  
HETATM    4  C   UNL     1       4.290  -1.512   0.366  1.00  0.00           C  
HETATM    5  C   UNL     1       5.341  -0.620   0.317  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.202  -1.104  -1.320  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.857   0.505  -1.334  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.034   1.425  -0.717  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.732   1.057  -0.388  1.00  0.00           C  
HETATM   10  C   UNL     1       6.697   1.886  -1.334  1.00  0.00           C  
HETATM   11  C   UNL     1       2.979  -1.047   0.271  1.00  0.00           C  
HETATM   12  C   UNL     1       2.739   0.317   0.116  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.661   3.151  -0.597  1.00  0.00           C  
HETATM   14  C   UNL     1       2.084  -3.357   0.570  1.00  0.00           C  
HETATM   15  C   UNL     1       1.845  -2.002   0.322  1.00  0.00           C  
HETATM   16  N   UNL     1       0.606  -1.569   0.134  1.00  0.00           N  
HETATM   17  C   UNL     1      -0.409  -2.424   0.180  1.00  0.00           C  
HETATM   18  C   UNL     1      -0.165  -3.786   0.429  1.00  0.00           C  
HETATM   19  N   UNL     1       1.080  -4.211   0.618  1.00  0.00           N  
HETATM   20  N   UNL     1      -1.217  -4.681   0.479  1.00  0.00           N  
HETATM   21  C   UNL     1      -1.791  -1.946  -0.029  1.00  0.00           C  
HETATM   22  O   UNL     1      -2.727  -2.707   0.121  1.00  0.00           O  
HETATM   23  N   UNL     1      -2.014  -0.666  -0.387  1.00  0.00           N  
HETATM   24  C   UNL     1       5.096   0.734   0.169  1.00  0.00           C  
HETATM   25  N   UNL     1      -5.428  -0.711  -1.613  1.00  0.00           N  
HETATM   26  O   UNL     1       7.789   2.805  -1.384  1.00  0.00           O  
HETATM   27  N   UNL     1      -2.869   1.957   0.235  1.00  0.00           N  
HETATM   28  C   UNL     1      -1.665   4.083   0.096  1.00  0.00           C  
HETATM   29  O   UNL     1      -2.153   4.410   1.400  1.00  0.00           O  
HETATM   30  C   UNL     1      -2.365   3.271   2.238  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.370   2.330   1.566  1.00  0.00           C  
HETATM   32  H   UNL     1       3.612   2.257  -0.051  1.00  0.00           H  
HETATM   33  H   UNL     1       7.078   1.314   0.707  1.00  0.00           H  
HETATM   34  H   UNL     1       5.933   2.665   0.523  1.00  0.00           H  
HETATM   35  H   UNL     1       4.482  -2.569   0.476  1.00  0.00           H  
HETATM   36  H   UNL     1       6.357  -0.979   0.390  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.890  -2.108  -1.566  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.868   0.785  -1.591  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.394   2.418  -0.493  1.00  0.00           H  
HETATM   40  H   UNL     1       7.012   0.925  -1.740  1.00  0.00           H  
HETATM   41  H   UNL     1       5.867   2.275  -1.925  1.00  0.00           H  
HETATM   42  H   UNL     1       1.725   0.682   0.034  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.267   2.853  -1.568  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.611   3.669  -0.733  1.00  0.00           H  
HETATM   45  H   UNL     1       3.095  -3.707   0.719  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.115  -4.386   0.259  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.058  -5.603   0.733  1.00  0.00           H  
HETATM   48  H   UNL     1      -1.276  -0.038  -0.426  1.00  0.00           H  
HETATM   49  H   UNL     1       8.126   2.969  -2.275  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.700   3.584   0.184  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.551   4.995  -0.490  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.420   2.748   2.388  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.758   3.596   3.201  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.330   2.835   1.466  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.491   1.433   2.174  1.00  0.00           H  
CONECT    1   24   12   12   32                                       
CONECT    2    9   23    6    6                                       
CONECT    3   10   24   33   34                                       
CONECT    4    5   11   11   35                                       
CONECT    5   24   24    4   36                                       
CONECT    6    2    2   25   37                                       
CONECT    7    8   25   25   38                                       
CONECT    8    9    9    7   39                                       
CONECT    9   27    8    8    2                                       
CONECT   10   26    3   40   41                                       
CONECT   11    4    4   12   15                                       
CONECT   12    1    1   11   42                                       
CONECT   13   28   27   43   44                                       
CONECT   14   15   15   19   45                                       
CONECT   15   11   14   14   16                                       
CONECT   16   15   17   17                                            
CONECT   17   16   16   18   21                                       
CONECT   18   19   19   17   20                                       
CONECT   19   14   18   18                                            
CONECT   20   18   46   47                                            
CONECT   21   17   23   22   22                                       
CONECT   22   21   21                                                 
CONECT   23    2   21   48                                            
CONECT   24    3    5    5    1                                       
CONECT   25    7    7    6                                            
CONECT   26   10   49                                                 
CONECT   27   31   13    9                                            
CONECT   28   29   13   50   51                                       
CONECT   29   30   28                                                 
CONECT   30   29   31   52   53                                       
CONECT   31   30   27   54   55                                       
CONECT   32    1                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40   10                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   23                                                      
CONECT   49   26                                                      
CONECT   50   28                                                      
CONECT   51   28                                                      
CONECT   52   30                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
CONECT   55   31                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
