COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.709  -0.007   0.122  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.826  -3.251   0.839  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.178   0.210  -0.005  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.646   3.454  -0.739  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.301  -1.383   0.393  1.00  0.00           N  
HETATM    6  C   UNL     1       1.014  -1.214   0.231  1.00  0.00           C  
HETATM    7  C   UNL     1       1.648  -2.539   0.197  1.00  0.00           C  
HETATM    8  C   UNL     1       0.665  -3.443   0.401  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.579  -2.677   0.557  1.00  0.00           C  
HETATM   10  C   UNL     1       0.814  -4.941   0.458  1.00  0.00           C  
HETATM   11  C   UNL     1       3.110  -2.833  -0.023  1.00  0.00           C  
HETATM   12  C   UNL     1       3.400  -2.882  -1.525  1.00  0.00           C  
HETATM   13  C   UNL     1       4.861  -3.176  -1.745  1.00  0.00           C  
HETATM   14  O   UNL     1       5.596  -3.331  -0.799  1.00  0.00           O  
HETATM   15  O   UNL     1       5.347  -3.265  -2.993  1.00  0.00           O  
HETATM   16  N   UNL     1      -3.189  -1.224   0.395  1.00  0.00           N  
HETATM   17  C   UNL     1      -3.010  -2.531   0.789  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.268  -3.045   1.159  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.202  -2.084   0.927  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.541  -0.954   0.406  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.533  -4.420   1.716  1.00  0.00           C  
HETATM   22  N   UNL     1      -3.167   1.571  -0.345  1.00  0.00           N  
HETATM   23  C   UNL     1      -4.480   1.344  -0.430  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.109   2.511  -1.066  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.125   3.415  -1.270  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.887   2.806  -0.765  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.565   2.668  -1.420  1.00  0.00           C  
HETATM   28  N   UNL     1      -0.279   1.445  -0.221  1.00  0.00           N  
HETATM   29  C   UNL     1      -0.458   2.789  -0.469  1.00  0.00           C  
HETATM   30  C   UNL     1       0.802   3.411  -0.396  1.00  0.00           C  
HETATM   31  C   UNL     1       1.733   2.450  -0.157  1.00  0.00           C  
HETATM   32  C   UNL     1       1.069   1.213  -0.069  1.00  0.00           C  
HETATM   33  C   UNL     1       1.072   4.885  -0.556  1.00  0.00           C  
HETATM   34  C   UNL     1       3.217   2.671  -0.012  1.00  0.00           C  
HETATM   35  C   UNL     1       3.551   2.937   1.457  1.00  0.00           C  
HETATM   36  C   UNL     1       5.035   3.158   1.602  1.00  0.00           C  
HETATM   37  O   UNL     1       5.561   3.411   2.811  1.00  0.00           O  
HETATM   38  O   UNL     1       5.751   3.109   0.630  1.00  0.00           O  
HETATM   39  H   UNL     1       2.796  -0.022   0.164  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.862  -4.298   1.131  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.265   0.249   0.026  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.609   4.519  -0.957  1.00  0.00           H  
HETATM   43  H   UNL     1       1.010  -5.248   1.485  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.105  -5.411   0.108  1.00  0.00           H  
HETATM   45  H   UNL     1       1.644  -5.248  -0.178  1.00  0.00           H  
HETATM   46  H   UNL     1       3.712  -2.050   0.438  1.00  0.00           H  
HETATM   47  H   UNL     1       3.359  -3.795   0.426  1.00  0.00           H  
HETATM   48  H   UNL     1       2.798  -3.665  -1.986  1.00  0.00           H  
HETATM   49  H   UNL     1       3.151  -1.920  -1.974  1.00  0.00           H  
HETATM   50  H   UNL     1       6.291  -3.455  -3.085  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.487  -0.600   0.152  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.263  -2.172   1.109  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.463  -4.391   2.803  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.532  -4.744   1.424  1.00  0.00           H  
HETATM   55  H   UNL     1      -3.795  -5.119   1.323  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.229   4.392  -1.718  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.097   3.112  -0.579  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.659   3.315  -2.292  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.992   1.691  -1.644  1.00  0.00           H  
HETATM   60  H   UNL     1      -0.982   0.779  -0.163  1.00  0.00           H  
HETATM   61  H   UNL     1       1.260   5.108  -1.607  1.00  0.00           H  
HETATM   62  H   UNL     1       0.206   5.452  -0.214  1.00  0.00           H  
HETATM   63  H   UNL     1       1.944   5.161   0.036  1.00  0.00           H  
HETATM   64  H   UNL     1       3.751   1.784  -0.352  1.00  0.00           H  
HETATM   65  H   UNL     1       3.517   3.529  -0.614  1.00  0.00           H  
HETATM   66  H   UNL     1       3.017   3.825   1.796  1.00  0.00           H  
HETATM   67  H   UNL     1       3.251   2.080   2.059  1.00  0.00           H  
HETATM   68  H   UNL     1       6.517   3.546   2.854  1.00  0.00           H  
CONECT    1   32    6    6   39                                       
CONECT    2    9   17   17   40                                       
CONECT    3   23   20   20   41                                       
CONECT    4   29   26   26   42                                       
CONECT    5    6    9    9                                            
CONECT    6    1    1    7    5                                       
CONECT    7   11    6    8    8                                       
CONECT    8    7    7   10    9                                       
CONECT    9    5    5    8    2                                       
CONECT   10    8   43   44   45                                       
CONECT   11   12    7   46   47                                       
CONECT   12   13   11   48   49                                       
CONECT   13   14   14   15   12                                       
CONECT   14   13   13                                                 
CONECT   15   13   50                                                 
CONECT   16   20   17   51                                            
CONECT   17   16    2    2   18                                       
CONECT   18   17   19   19   21                                       
CONECT   19   20   18   18   52                                       
CONECT   20    3    3   16   19                                       
CONECT   21   18   53   54   55                                       
CONECT   22   26   23   23                                            
CONECT   23   24   22   22    3                                       
CONECT   24   25   25   27   23                                       
CONECT   25   26   24   24   56                                       
CONECT   26    4    4   25   22                                       
CONECT   27   24   57   58   59                                       
CONECT   28   29   32   60                                            
CONECT   29   30   30    4   28                                       
CONECT   30   33   31   29   29                                       
CONECT   31   34   30   32   32                                       
CONECT   32   31   31    1   28                                       
CONECT   33   30   61   62   63                                       
CONECT   34   35   31   64   65                                       
CONECT   35   36   34   66   67                                       
CONECT   36   38   38   37   35                                       
CONECT   37   36   68                                                 
CONECT   38   36   36                                                 
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    3                                                      
CONECT   42    4                                                      
CONECT   43   10                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   12                                                      
CONECT   50   15                                                      
CONECT   51   16                                                      
CONECT   52   19                                                      
CONECT   53   21                                                      
CONECT   54   21                                                      
CONECT   55   21                                                      
CONECT   56   25                                                      
CONECT   57   27                                                      
CONECT   58   27                                                      
CONECT   59   27                                                      
CONECT   60   28                                                      
CONECT   61   33                                                      
CONECT   62   33                                                      
CONECT   63   33                                                      
CONECT   64   34                                                      
CONECT   65   34                                                      
CONECT   66   35                                                      
CONECT   67   35                                                      
CONECT   68   37                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
