COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -2.732   0.999   1.361  1.00  0.00           O  
HETATM    2  C   UNL     1      -1.729   0.659   0.780  1.00  0.00           C  
HETATM    3  O   UNL     1      -0.689   1.503   0.685  1.00  0.00           O  
HETATM    4  C   UNL     1      -1.642  -0.716   0.168  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.948  -1.471   0.423  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.076  -0.782  -0.300  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.390  -1.145  -1.596  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.425  -0.514  -2.260  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.147   0.481  -1.627  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.834   0.844  -0.330  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.620   1.928   0.360  1.00  0.00           C  
HETATM   12  N   UNL     1      -7.763   1.332   1.064  1.00  0.00           N  
HETATM   13  C   UNL     1      -4.802   0.209   0.335  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.478  -1.482   0.797  1.00  0.00           C  
HETATM   15  P   UNL     1       1.097  -0.849   0.133  1.00  0.00           P  
HETATM   16  O   UNL     1       1.074  -0.922  -1.345  1.00  0.00           O  
HETATM   17  O   UNL     1       1.297   0.681   0.592  1.00  0.00           O  
HETATM   18  C   UNL     1       2.475  -1.859   0.769  1.00  0.00           C  
HETATM   19  N   UNL     1       2.293  -3.255   0.350  1.00  0.00           N  
HETATM   20  C   UNL     1       3.797  -1.328   0.211  1.00  0.00           C  
HETATM   21  C   UNL     1       3.987   0.126   0.647  1.00  0.00           C  
HETATM   22  C   UNL     1       5.289   0.650   0.097  1.00  0.00           C  
HETATM   23  C   UNL     1       6.453   0.515   0.831  1.00  0.00           C  
HETATM   24  C   UNL     1       5.320   1.260  -1.142  1.00  0.00           C  
HETATM   25  C   UNL     1       6.514   1.740  -1.647  1.00  0.00           C  
HETATM   26  C   UNL     1       7.677   1.610  -0.911  1.00  0.00           C  
HETATM   27  C   UNL     1       7.647   0.995   0.327  1.00  0.00           C  
HETATM   28  H   UNL     1      -0.790   2.372   1.097  1.00  0.00           H  
HETATM   29  H   UNL     1      -1.479  -0.625  -0.906  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.853  -2.494   0.058  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.156  -1.484   1.493  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.826  -1.922  -2.091  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.670  -0.797  -3.273  1.00  0.00           H  
HETATM   34  H   UNL     1      -6.956   0.975  -2.145  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.980   2.441   1.077  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.982   2.642  -0.380  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.458   0.620   1.711  1.00  0.00           H  
HETATM   38  H   UNL     1      -8.307   2.039   1.535  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.560   0.489   1.349  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.496  -1.347   1.879  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.571  -2.543   0.562  1.00  0.00           H  
HETATM   42  H   UNL     1       1.322   0.804   1.551  1.00  0.00           H  
HETATM   43  H   UNL     1       2.493  -1.806   1.857  1.00  0.00           H  
HETATM   44  H   UNL     1       1.459  -3.650   0.758  1.00  0.00           H  
HETATM   45  H   UNL     1       2.274  -3.331  -0.656  1.00  0.00           H  
HETATM   46  H   UNL     1       4.621  -1.932   0.591  1.00  0.00           H  
HETATM   47  H   UNL     1       3.780  -1.381  -0.878  1.00  0.00           H  
HETATM   48  H   UNL     1       3.163   0.730   0.267  1.00  0.00           H  
HETATM   49  H   UNL     1       4.004   0.180   1.736  1.00  0.00           H  
HETATM   50  H   UNL     1       6.429   0.034   1.798  1.00  0.00           H  
HETATM   51  H   UNL     1       4.411   1.362  -1.717  1.00  0.00           H  
HETATM   52  H   UNL     1       6.539   2.217  -2.615  1.00  0.00           H  
HETATM   53  H   UNL     1       8.611   1.984  -1.305  1.00  0.00           H  
HETATM   54  H   UNL     1       8.556   0.890   0.900  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    4    1    1    3                                       
CONECT    3    2   28                                                 
CONECT    4    5   14    2   29                                       
CONECT    5    6    4   30   31                                       
CONECT    6    5    7    7   13                                       
CONECT    7    6    6    8   32                                       
CONECT    8    7    9    9   33                                       
CONECT    9    8    8   10   34                                       
CONECT   10   13   13    9   11                                       
CONECT   11   10   12   35   36                                       
CONECT   12   11   37   38                                            
CONECT   13    6   10   10   39                                       
CONECT   14   15    4   40   41                                       
CONECT   15   16   16   18   14                                       
CONECT   15   17                                                      
CONECT   16   15   15                                                 
CONECT   17   15   42                                                 
CONECT   18   15   19   20   43                                       
CONECT   19   18   44   45                                            
CONECT   20   18   21   46   47                                       
CONECT   21   20   22   48   49                                       
CONECT   22   23   21   24   24                                       
CONECT   23   27   27   22   50                                       
CONECT   24   22   22   25   51                                       
CONECT   25   26   26   24   52                                       
CONECT   26   27   25   25   53                                       
CONECT   27   23   23   26   54                                       
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    5                                                      
CONECT   32    7                                                      
CONECT   33    8                                                      
CONECT   34    9                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   12                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   19                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   26                                                      
CONECT   54   27                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
