COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       1.246  -3.739   1.427  1.00  0.00           O  
HETATM    2  O   UNL     1       4.115   0.774  -2.483  1.00  0.00           O  
HETATM    3  O   UNL     1       6.918  -1.857   0.316  1.00  0.00           O  
HETATM    4  N   UNL     1       0.773   0.328   0.829  1.00  0.00           N  
HETATM    5  N   UNL     1      -0.559   2.151   0.334  1.00  0.00           N  
HETATM    6  N   UNL     1      -0.821  -4.203   0.755  1.00  0.00           N  
HETATM    7  C   UNL     1      -1.360  -1.367   0.469  1.00  0.00           C  
HETATM    8  N   UNL     1       2.263  -1.413   1.355  1.00  0.00           N  
HETATM    9  C   UNL     1       5.527  -0.539  -1.091  1.00  0.00           C  
HETATM   10  C   UNL     1       0.718   3.387   2.014  1.00  0.00           C  
HETATM   11  C   UNL     1       4.608  -1.639   0.836  1.00  0.00           C  
HETATM   12  C   UNL     1       1.003  -0.974   1.007  1.00  0.00           C  
HETATM   13  C   UNL     1       0.171  -3.332   1.026  1.00  0.00           C  
HETATM   14  N   UNL     1      -1.487  -0.011   0.310  1.00  0.00           N  
HETATM   15  C   UNL     1       3.191  -0.309  -0.579  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.044  -1.896   0.839  1.00  0.00           C  
HETATM   17  C   UNL     1       3.356  -1.120   0.536  1.00  0.00           C  
HETATM   18  C   UNL     1       4.276  -0.020  -1.392  1.00  0.00           C  
HETATM   19  C   UNL     1       0.585   3.044   0.529  1.00  0.00           C  
HETATM   20  C   UNL     1       5.276   1.031  -3.276  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.408   0.799   0.497  1.00  0.00           C  
HETATM   22  C   UNL     1       5.692  -1.349   0.022  1.00  0.00           C  
HETATM   23  C   UNL     1       0.371   4.329  -0.274  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.559   4.081   2.493  1.00  0.00           C  
HETATM   25  C   UNL     1      -0.773   5.366   1.691  1.00  0.00           C  
HETATM   26  C   UNL     1       7.990  -1.517  -0.565  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.905   5.023   0.205  1.00  0.00           C  
HETATM   28  N   UNL     1       0.244   4.000  -1.700  1.00  0.00           N  
HETATM   29  N   UNL     1      -2.535  -1.914   0.234  1.00  0.00           N  
HETATM   30  N   UNL     1      -2.825   0.217  -0.037  1.00  0.00           N  
HETATM   31  C   UNL     1      -3.421  -0.958  -0.072  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.850  -1.186  -0.398  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.369  -2.479  -0.402  1.00  0.00           C  
HETATM   34  C   UNL     1      -5.679  -0.106  -0.695  1.00  0.00           C  
HETATM   35  C   UNL     1      -6.699  -2.688  -0.706  1.00  0.00           C  
HETATM   36  C   UNL     1      -7.013  -0.326  -0.999  1.00  0.00           C  
HETATM   37  C   UNL     1      -7.520  -1.618  -1.007  1.00  0.00           C  
HETATM   38  O   UNL     1      -7.825   0.725  -1.289  1.00  0.00           O  
HETATM   39  H   UNL     1      -0.678  -5.154   0.879  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.678  -3.878   0.435  1.00  0.00           H  
HETATM   41  H   UNL     1       2.390  -1.925   2.169  1.00  0.00           H  
HETATM   42  H   UNL     1       6.371  -0.317  -1.727  1.00  0.00           H  
HETATM   43  H   UNL     1       0.870   2.471   2.586  1.00  0.00           H  
HETATM   44  H   UNL     1       1.569   4.052   2.159  1.00  0.00           H  
HETATM   45  H   UNL     1       4.738  -2.270   1.704  1.00  0.00           H  
HETATM   46  H   UNL     1       2.218   0.096  -0.813  1.00  0.00           H  
HETATM   47  H   UNL     1       1.495   2.550   0.187  1.00  0.00           H  
HETATM   48  H   UNL     1       5.009   1.676  -4.113  1.00  0.00           H  
HETATM   49  H   UNL     1       6.031   1.525  -2.664  1.00  0.00           H  
HETATM   50  H   UNL     1       5.673   0.090  -3.655  1.00  0.00           H  
HETATM   51  H   UNL     1       1.222   4.994  -0.129  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.410   3.416   2.348  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.465   4.325   3.551  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.683   5.860   2.032  1.00  0.00           H  
HETATM   55  H   UNL     1       0.078   6.031   1.835  1.00  0.00           H  
HETATM   56  H   UNL     1       7.760  -1.870  -1.571  1.00  0.00           H  
HETATM   57  H   UNL     1       8.118  -0.435  -0.581  1.00  0.00           H  
HETATM   58  H   UNL     1       8.910  -1.987  -0.217  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.058   5.938  -0.367  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.757   4.358   0.060  1.00  0.00           H  
HETATM   61  H   UNL     1       0.102   4.833  -2.252  1.00  0.00           H  
HETATM   62  H   UNL     1       1.048   3.484  -2.025  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.729  -3.318  -0.169  1.00  0.00           H  
HETATM   64  H   UNL     1      -5.283   0.898  -0.688  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.099  -3.691  -0.710  1.00  0.00           H  
HETATM   66  H   UNL     1      -8.560  -1.787  -1.244  1.00  0.00           H  
HETATM   67  H   UNL     1      -7.852   0.953  -2.229  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.424   2.516   0.089  1.00  0.00           H  
CONECT    1   13   13                                                 
CONECT    2   18   20                                                 
CONECT    3   22   26                                                 
CONECT    4   12   21   21                                            
CONECT    5   19   21   68                                            
CONECT    6   13   39   40                                            
CONECT    7   14   16   29   29                                       
CONECT    8   12   17   41                                            
CONECT    9   18   18   22   42                                       
CONECT   10   19   24   43   44                                       
CONECT   11   17   22   22   45                                       
CONECT   12    4    8   16   16                                       
CONECT   13    1    1    6   16                                       
CONECT   14    7   21   30                                            
CONECT   15   17   17   18   46                                       
CONECT   16    7   12   12   13                                       
CONECT   17    8   11   15   15                                       
CONECT   18    2    9    9   15                                       
CONECT   19    5   10   23   47                                       
CONECT   20    2   48   49   50                                       
CONECT   21    4    4    5   14                                       
CONECT   22    3    9   11   11                                       
CONECT   23   19   27   28   51                                       
CONECT   24   10   25   52   53                                       
CONECT   25   24   27   54   55                                       
CONECT   26    3   56   57   58                                       
CONECT   27   23   25   59   60                                       
CONECT   28   23   61   62                                            
CONECT   29    7    7   31                                            
CONECT   30   14   31   31                                            
CONECT   31   29   30   30   32                                       
CONECT   32   31   33   33   34                                       
CONECT   33   32   32   35   63                                       
CONECT   34   32   36   36   64                                       
CONECT   35   33   37   37   65                                       
CONECT   36   34   34   37   38                                       
CONECT   37   35   35   36   66                                       
CONECT   38   36   67                                                 
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   10                                                      
CONECT   45   11                                                      
CONECT   46   15                                                      
CONECT   47   19                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   23                                                      
CONECT   52   24                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
CONECT   55   25                                                      
CONECT   56   26                                                      
CONECT   57   26                                                      
CONECT   58   26                                                      
CONECT   59   27                                                      
CONECT   60   27                                                      
CONECT   61   28                                                      
CONECT   62   28                                                      
CONECT   63   33                                                      
CONECT   64   34                                                      
CONECT   65   35                                                      
CONECT   66   37                                                      
CONECT   67   38                                                      
CONECT   68    5                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
