COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1      -3.258  -0.795   0.110  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.845  -0.754  -0.478  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.991   0.223   0.336  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.664   1.599   0.330  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.084   1.467   0.886  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.783   2.826   0.827  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.493  -2.982  -1.400  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.881  -4.357  -1.338  1.00  0.00           C  
HETATM    9  N   UNL     1      -1.250  -2.092  -0.417  1.00  0.00           N  
HETATM   10  O   UNL     1      -4.077  -1.663  -0.678  1.00  0.00           O  
HETATM   11  O   UNL     1       0.309   0.324  -0.250  1.00  0.00           O  
HETATM   12  O   UNL     1      -1.719   2.098  -1.008  1.00  0.00           O  
HETATM   13  O   UNL     1      -3.814   0.521   0.103  1.00  0.00           O  
HETATM   14  O   UNL     1      -5.065   2.730   1.452  1.00  0.00           O  
HETATM   15  O   UNL     1      -2.203  -2.675  -2.334  1.00  0.00           O  
HETATM   16  O   UNL     1       1.564  -0.531   1.522  1.00  0.00           O  
HETATM   17  C   UNL     1       1.348   0.609   0.688  1.00  0.00           C  
HETATM   18  C   UNL     1       2.639   0.940  -0.065  1.00  0.00           C  
HETATM   19  N   UNL     1       2.405   2.072  -0.965  1.00  0.00           N  
HETATM   20  C   UNL     1       3.072  -0.282  -0.881  1.00  0.00           C  
HETATM   21  O   UNL     1       4.315  -0.007  -1.530  1.00  0.00           O  
HETATM   22  C   UNL     1       3.239  -1.479   0.060  1.00  0.00           C  
HETATM   23  O   UNL     1       4.281  -1.206   1.000  1.00  0.00           O  
HETATM   24  C   UNL     1       1.925  -1.716   0.809  1.00  0.00           C  
HETATM   25  C   UNL     1       2.101  -2.872   1.796  1.00  0.00           C  
HETATM   26  O   UNL     1       0.846  -3.170   2.410  1.00  0.00           O  
HETATM   27  C   UNL     1       2.511   3.333  -0.503  1.00  0.00           C  
HETATM   28  O   UNL     1       2.802   3.532   0.658  1.00  0.00           O  
HETATM   29  C   UNL     1       2.270   4.498  -1.429  1.00  0.00           C  
HETATM   30  H   UNL     1      -3.216  -1.167   1.134  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.891  -0.421  -1.515  1.00  0.00           H  
HETATM   32  H   UNL     1      -0.902  -0.136   1.361  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.091   2.288   0.951  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.039   1.125   1.920  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.180   3.569   1.350  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.908   3.126  -0.213  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.188  -4.931  -2.213  1.00  0.00           H  
HETATM   38  H   UNL     1       0.206  -4.272  -1.322  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.218  -4.865  -0.434  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.682  -2.336   0.330  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.988  -1.737  -0.363  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.134   2.968  -1.087  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.566   3.557   1.452  1.00  0.00           H  
HETATM   44  H   UNL     1       1.059   1.460   1.305  1.00  0.00           H  
HETATM   45  H   UNL     1       3.422   1.197   0.648  1.00  0.00           H  
HETATM   46  H   UNL     1       2.172   1.913  -1.893  1.00  0.00           H  
HETATM   47  H   UNL     1       2.312  -0.508  -1.630  1.00  0.00           H  
HETATM   48  H   UNL     1       4.650  -0.740  -2.066  1.00  0.00           H  
HETATM   49  H   UNL     1       3.494  -2.365  -0.519  1.00  0.00           H  
HETATM   50  H   UNL     1       4.441  -1.922   1.628  1.00  0.00           H  
HETATM   51  H   UNL     1       1.139  -1.964   0.095  1.00  0.00           H  
HETATM   52  H   UNL     1       2.822  -2.588   2.562  1.00  0.00           H  
HETATM   53  H   UNL     1       2.401   5.431  -0.881  1.00  0.00           H  
HETATM   54  H   UNL     1       1.254   4.446  -1.820  1.00  0.00           H  
HETATM   55  H   UNL     1       2.980   4.459  -2.254  1.00  0.00           H  
HETATM   56  H   UNL     1       2.463  -3.751   1.264  1.00  0.00           H  
HETATM   57  H   UNL     1       0.882  -3.894   3.049  1.00  0.00           H  
CONECT    1    2   13   10   30                                       
CONECT    2    1    3    9   31                                       
CONECT    3    2   11    4   32                                       
CONECT    4   12    3    5   33                                       
CONECT    5    4   13    6   34                                       
CONECT    6    5   14   35   36                                       
CONECT    7   15   15    8    9                                       
CONECT    8    7   37   38   39                                       
CONECT    9    2    7   40                                            
CONECT   10    1   41                                                 
CONECT   11   17    3                                                 
CONECT   12    4   42                                                 
CONECT   13    1    5                                                 
CONECT   14    6   43                                                 
CONECT   15    7    7                                                 
CONECT   16   24   17                                                 
CONECT   17   18   16   11   44                                       
CONECT   18   20   19   17   45                                       
CONECT   19   18   27   46                                            
CONECT   20   18   21   22   47                                       
CONECT   21   20   48                                                 
CONECT   22   20   23   24   49                                       
CONECT   23   22   50                                                 
CONECT   24   22   25   16   51                                       
CONECT   25   24   26   56   52                                       
CONECT   26   25   57                                                 
CONECT   27   29   19   28   28                                       
CONECT   28   27   27                                                 
CONECT   29   27   54   53   55                                       
CONECT   30    1                                                      
CONECT   31    2                                                      
CONECT   32    3                                                      
CONECT   33    4                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37    8                                                      
CONECT   38    8                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   12                                                      
CONECT   43   14                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   19                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   25                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
CONECT   55   29                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
