COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.844  -3.753   0.894  1.00  0.00           O  
HETATM    2  C   UNL     1       3.546  -3.584  -0.265  1.00  0.00           C  
HETATM    3  O   UNL     1       4.233  -4.212  -1.232  1.00  0.00           O  
HETATM    4  C   UNL     1       2.400  -2.674  -0.624  1.00  0.00           C  
HETATM    5  C   UNL     1       1.789  -2.095   0.654  1.00  0.00           C  
HETATM    6  N   UNL     1       0.675  -1.210   0.304  1.00  0.00           N  
HETATM    7  C   UNL     1       0.788   0.136   0.056  1.00  0.00           C  
HETATM    8  C   UNL     1       2.044   0.910   0.099  1.00  0.00           C  
HETATM    9  C   UNL     1       2.341   1.823  -0.916  1.00  0.00           C  
HETATM   10  C   UNL     1       3.516   2.544  -0.870  1.00  0.00           C  
HETATM   11  C   UNL     1       4.401   2.364   0.179  1.00  0.00           C  
HETATM   12  C   UNL     1       4.114   1.461   1.188  1.00  0.00           C  
HETATM   13  C   UNL     1       2.939   0.738   1.157  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.458   0.649  -0.240  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.401  -0.477  -0.165  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.777  -0.595  -0.358  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.384  -1.822  -0.211  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.871  -1.953  -0.418  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.459  -3.365  -0.442  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.707  -2.453   0.761  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.633  -2.939   0.127  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.273  -2.839   0.321  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.638  -1.609   0.171  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.781   2.054  -0.568  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.762   2.506  -1.892  1.00  0.00           C  
HETATM   26  C   UNL     1      -1.071   3.824  -2.154  1.00  0.00           C  
HETATM   27  N   UNL     1      -1.381   4.657  -1.179  1.00  0.00           N  
HETATM   28  C   UNL     1      -1.412   4.276   0.085  1.00  0.00           C  
HETATM   29  C   UNL     1      -1.122   2.971   0.439  1.00  0.00           C  
HETATM   30  O   UNL     1      -1.161   2.583   1.742  1.00  0.00           O  
HETATM   31  C   UNL     1      -1.517   3.578   2.704  1.00  0.00           C  
HETATM   32  H   UNL     1       4.957  -4.789  -0.952  1.00  0.00           H  
HETATM   33  H   UNL     1       2.765  -1.862  -1.253  1.00  0.00           H  
HETATM   34  H   UNL     1       1.642  -3.240  -1.165  1.00  0.00           H  
HETATM   35  H   UNL     1       1.425  -2.907   1.282  1.00  0.00           H  
HETATM   36  H   UNL     1       2.547  -1.529   1.195  1.00  0.00           H  
HETATM   37  H   UNL     1       1.651   1.964  -1.735  1.00  0.00           H  
HETATM   38  H   UNL     1       3.746   3.250  -1.654  1.00  0.00           H  
HETATM   39  H   UNL     1       5.322   2.927   0.208  1.00  0.00           H  
HETATM   40  H   UNL     1       4.809   1.326   2.003  1.00  0.00           H  
HETATM   41  H   UNL     1       2.717   0.034   1.945  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.365   0.273  -0.621  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.321  -1.209  -1.075  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.297  -3.550  -1.114  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.771  -4.199  -0.308  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.182  -2.687   1.687  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.708  -2.038   0.880  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.120  -3.896   0.239  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.698  -3.714   0.584  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.509   1.832  -2.698  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.058   4.181  -3.174  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.671   4.992   0.851  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.511   3.138   3.701  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.798   4.396   2.663  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.514   3.959   2.481  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    4                                       
CONECT    3    2   32                                                 
CONECT    4    2    5   33   34                                       
CONECT    5    4    6   35   36                                       
CONECT    6    5    7   23                                            
CONECT    7    8    6   14   14                                       
CONECT    8   13   13    9    7                                       
CONECT    9   10   10    8   37                                       
CONECT   10   11    9    9   38                                       
CONECT   11   12   12   10   39                                       
CONECT   12   11   11   13   40                                       
CONECT   13   12    8    8   41                                       
CONECT   14    7    7   24   15                                       
CONECT   15   14   23   16   16                                       
CONECT   16   15   15   17   42                                       
CONECT   17   16   21   21   18                                       
CONECT   18   17   20   19   43                                       
CONECT   19   18   20   44   45                                       
CONECT   20   18   19   46   47                                       
CONECT   21   22   17   17   48                                       
CONECT   22   23   23   21   49                                       
CONECT   23    6   15   22   22                                       
CONECT   24   25   25   14   29                                       
CONECT   25   26   24   24   50                                       
CONECT   26   25   27   27   51                                       
CONECT   27   26   26   28                                            
CONECT   28   27   29   29   52                                       
CONECT   29   24   28   28   30                                       
CONECT   30   29   31                                                 
CONECT   31   30   53   54   55                                       
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    5                                                      
CONECT   36    5                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   16                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   28                                                      
CONECT   53   31                                                      
CONECT   54   31                                                      
CONECT   55   31                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
