COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.270   2.642   0.158  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.654   1.278  -0.371  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.010   0.866   0.206  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.455  -0.453  -0.429  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.867  -0.798   0.048  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.859   0.240  -0.487  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.257  -0.171  -0.108  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.699  -2.457  -0.107  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.268  -2.177  -0.486  1.00  0.00           C  
HETATM   10  C   UNL     1       0.416   0.269   0.058  1.00  0.00           C  
HETATM   11  C   UNL     1       1.790   0.760  -0.402  1.00  0.00           C  
HETATM   12  C   UNL     1       4.096  -0.029  -0.382  1.00  0.00           C  
HETATM   13  C   UNL     1       5.117  -1.044  -0.047  1.00  0.00           C  
HETATM   14  C   UNL     1       6.457  -0.822  -0.369  1.00  0.00           C  
HETATM   15  C   UNL     1       7.405  -1.773  -0.053  1.00  0.00           C  
HETATM   16  C   UNL     1       7.031  -2.944   0.581  1.00  0.00           C  
HETATM   17  C   UNL     1       5.704  -3.170   0.903  1.00  0.00           C  
HETATM   18  C   UNL     1       4.747  -2.224   0.599  1.00  0.00           C  
HETATM   19  C   UNL     1       1.771   0.981  -1.916  1.00  0.00           C  
HETATM   20  C   UNL     1       2.132   2.076   0.298  1.00  0.00           C  
HETATM   21  C   UNL     1       1.126   3.153  -0.122  1.00  0.00           C  
HETATM   22  C   UNL     1       1.376   4.431   0.680  1.00  0.00           C  
HETATM   23  N   UNL     1      -6.585  -1.462   0.050  1.00  0.00           N  
HETATM   24  N   UNL     1       2.803  -0.246  -0.069  1.00  0.00           N  
HETATM   25  O   UNL     1      -1.059   3.308   0.784  1.00  0.00           O  
HETATM   26  O   UNL     1      -1.894   0.697   1.620  1.00  0.00           O  
HETATM   27  O   UNL     1      -6.056  -3.603   0.059  1.00  0.00           O  
HETATM   28  O   UNL     1      -7.103   0.681   0.058  1.00  0.00           O  
HETATM   29  O   UNL     1       4.422   1.001  -0.940  1.00  0.00           O  
HETATM   30  H   UNL     1      -0.715   1.311  -1.459  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.747   1.640  -0.009  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.453  -0.352  -1.515  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.768  -1.247  -0.137  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.893  -0.806   1.138  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.636   1.215  -0.053  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.778   0.296  -1.572  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.170  -2.190  -1.571  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.621  -2.939  -0.051  1.00  0.00           H  
HETATM   39  H   UNL     1       0.410   0.172   1.144  1.00  0.00           H  
HETATM   40  H   UNL     1       0.206  -0.700  -0.395  1.00  0.00           H  
HETATM   41  H   UNL     1       6.751   0.091  -0.865  1.00  0.00           H  
HETATM   42  H   UNL     1       8.443  -1.604  -0.303  1.00  0.00           H  
HETATM   43  H   UNL     1       7.777  -3.685   0.826  1.00  0.00           H  
HETATM   44  H   UNL     1       5.418  -4.086   1.398  1.00  0.00           H  
HETATM   45  H   UNL     1       3.713  -2.400   0.855  1.00  0.00           H  
HETATM   46  H   UNL     1       1.016   1.727  -2.164  1.00  0.00           H  
HETATM   47  H   UNL     1       2.750   1.330  -2.244  1.00  0.00           H  
HETATM   48  H   UNL     1       1.533   0.043  -2.417  1.00  0.00           H  
HETATM   49  H   UNL     1       2.085   1.936   1.378  1.00  0.00           H  
HETATM   50  H   UNL     1       3.138   2.388   0.016  1.00  0.00           H  
HETATM   51  H   UNL     1       1.234   3.358  -1.187  1.00  0.00           H  
HETATM   52  H   UNL     1       2.388   4.788   0.489  1.00  0.00           H  
HETATM   53  H   UNL     1       0.659   5.195   0.379  1.00  0.00           H  
HETATM   54  H   UNL     1       1.259   4.222   1.743  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.498  -1.686   0.288  1.00  0.00           H  
HETATM   56  H   UNL     1       2.542  -1.067   0.375  1.00  0.00           H  
HETATM   57  H   UNL     1      -1.254   0.023   1.885  1.00  0.00           H  
CONECT    1   21   25   25    2                                       
CONECT    2    1    3   10   30                                       
CONECT    3    2    4   26   31                                       
CONECT    4    3    5   32   33                                       
CONECT    5    6    4    9   34                                       
CONECT    6    7    5   35   36                                       
CONECT    7   28   28    6   23                                       
CONECT    8   23    9   27   27                                       
CONECT    9    5    8   37   38                                       
CONECT   10    2   11   39   40                                       
CONECT   11   19   20   10   24                                       
CONECT   12   29   29   24   13                                       
CONECT   13   12   18   18   14                                       
CONECT   14   13   15   15   41                                       
CONECT   15   14   14   16   42                                       
CONECT   16   17   17   15   43                                       
CONECT   17   18   16   16   44                                       
CONECT   18   13   13   17   45                                       
CONECT   19   11   46   47   48                                       
CONECT   20   21   11   49   50                                       
CONECT   21   22   20    1   51                                       
CONECT   22   21   52   53   54                                       
CONECT   23    7    8   55                                            
CONECT   24   11   12   56                                            
CONECT   25    1    1                                                 
CONECT   26    3   57                                                 
CONECT   27    8    8                                                 
CONECT   28    7    7                                                 
CONECT   29   12   12                                                 
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    4                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   14                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   19                                                      
CONECT   48   19                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   26                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
