COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -2.380   0.831  -2.021  1.00  0.00           O  
HETATM    2  C   UNL     1      -2.305   1.329  -0.917  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.926   2.780  -0.769  1.00  0.00           C  
HETATM    4  N   UNL     1      -2.565   0.585   0.176  1.00  0.00           N  
HETATM    5  C   UNL     1      -2.939  -0.824   0.032  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.218  -0.930  -0.800  1.00  0.00           C  
HETATM    7  C   UNL     1      -5.359  -0.290  -0.051  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.632   1.054  -0.225  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.677   1.641   0.463  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.450   0.885   1.324  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.177  -0.459   1.497  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.135  -1.048   0.805  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.810  -1.582  -0.671  1.00  0.00           C  
HETATM   14  O   UNL     1      -2.175  -2.956  -0.812  1.00  0.00           O  
HETATM   15  C   UNL     1      -0.530  -1.476   0.161  1.00  0.00           C  
HETATM   16  N   UNL     1       0.581  -2.100  -0.569  1.00  0.00           N  
HETATM   17  C   UNL     1       1.829  -2.018   0.201  1.00  0.00           C  
HETATM   18  C   UNL     1       2.513  -0.702  -0.077  1.00  0.00           C  
HETATM   19  C   UNL     1       3.893  -0.575  -0.308  1.00  0.00           C  
HETATM   20  C   UNL     1       4.849  -1.742  -0.300  1.00  0.00           C  
HETATM   21  C   UNL     1       4.158  -2.924   0.392  1.00  0.00           C  
HETATM   22  C   UNL     1       4.006  -2.621   1.884  1.00  0.00           C  
HETATM   23  C   UNL     1       5.004  -4.185   0.213  1.00  0.00           C  
HETATM   24  C   UNL     1       2.776  -3.148  -0.224  1.00  0.00           C  
HETATM   25  N   UNL     1       4.157   0.682  -0.516  1.00  0.00           N  
HETATM   26  N   UNL     1       2.956   1.402  -0.423  1.00  0.00           N  
HETATM   27  C   UNL     1       1.963   0.525  -0.152  1.00  0.00           C  
HETATM   28  C   UNL     1       2.804   2.849  -0.590  1.00  0.00           C  
HETATM   29  C   UNL     1       3.746   3.575   0.373  1.00  0.00           C  
HETATM   30  C   UNL     1       5.191   3.176   0.070  1.00  0.00           C  
HETATM   31  C   UNL     1       3.587   5.087   0.199  1.00  0.00           C  
HETATM   32  C   UNL     1       3.400   3.189   1.812  1.00  0.00           C  
HETATM   33  H   UNL     1      -1.760   3.214  -1.754  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.732   3.316  -0.266  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.014   2.859  -0.178  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.505   0.983   1.059  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.109  -1.258   1.017  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.076  -0.418  -1.752  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.448  -1.980  -0.983  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.028   1.646  -0.897  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.891   2.691   0.328  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.266   1.344   1.862  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.780  -1.050   2.171  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.922  -2.098   0.941  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.640  -1.148  -1.656  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.342  -3.407   0.027  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.301  -0.427   0.344  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.672  -1.988   1.113  1.00  0.00           H  
HETATM   49  H   UNL     1       0.366  -3.057  -0.807  1.00  0.00           H  
HETATM   50  H   UNL     1       1.611  -2.102   1.265  1.00  0.00           H  
HETATM   51  H   UNL     1       5.105  -2.015  -1.324  1.00  0.00           H  
HETATM   52  H   UNL     1       5.753  -1.474   0.247  1.00  0.00           H  
HETATM   53  H   UNL     1       3.405  -1.721   2.013  1.00  0.00           H  
HETATM   54  H   UNL     1       3.515  -3.460   2.377  1.00  0.00           H  
HETATM   55  H   UNL     1       4.990  -2.466   2.326  1.00  0.00           H  
HETATM   56  H   UNL     1       5.988  -4.029   0.656  1.00  0.00           H  
HETATM   57  H   UNL     1       4.514  -5.025   0.704  1.00  0.00           H  
HETATM   58  H   UNL     1       5.115  -4.400  -0.850  1.00  0.00           H  
HETATM   59  H   UNL     1       2.377  -4.103   0.117  1.00  0.00           H  
HETATM   60  H   UNL     1       2.861  -3.159  -1.311  1.00  0.00           H  
HETATM   61  H   UNL     1       0.919   0.764  -0.020  1.00  0.00           H  
HETATM   62  H   UNL     1       3.050   3.125  -1.615  1.00  0.00           H  
HETATM   63  H   UNL     1       1.774   3.134  -0.374  1.00  0.00           H  
HETATM   64  H   UNL     1       5.437   3.451  -0.955  1.00  0.00           H  
HETATM   65  H   UNL     1       5.862   3.693   0.756  1.00  0.00           H  
HETATM   66  H   UNL     1       5.304   2.099   0.194  1.00  0.00           H  
HETATM   67  H   UNL     1       3.833   5.362  -0.827  1.00  0.00           H  
HETATM   68  H   UNL     1       2.557   5.371   0.414  1.00  0.00           H  
HETATM   69  H   UNL     1       4.258   5.604   0.885  1.00  0.00           H  
HETATM   70  H   UNL     1       4.071   3.706   2.498  1.00  0.00           H  
HETATM   71  H   UNL     1       2.370   3.473   2.028  1.00  0.00           H  
HETATM   72  H   UNL     1       3.513   2.112   1.937  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    4    1    1    3                                       
CONECT    3    2   33   34   35                                       
CONECT    4    5    2   36                                            
CONECT    5    6   13    4   37                                       
CONECT    6    7    5   38   39                                       
CONECT    7    8    8   12    6                                       
CONECT    8    9    7    7   40                                       
CONECT    9   10   10    8   41                                       
CONECT   10    9    9   11   42                                       
CONECT   11   10   12   12   43                                       
CONECT   12   11   11    7   44                                       
CONECT   13   14    5   15   45                                       
CONECT   14   13   46                                                 
CONECT   15   13   16   47   48                                       
CONECT   16   15   17   49                                            
CONECT   17   18   16   24   50                                       
CONECT   18   27   27   19   17                                       
CONECT   19   25   25   18   20                                       
CONECT   20   19   21   51   52                                       
CONECT   21   20   24   22   23                                       
CONECT   22   21   53   54   55                                       
CONECT   23   21   56   57   58                                       
CONECT   24   17   21   59   60                                       
CONECT   25   26   19   19                                            
CONECT   26   28   27   25                                            
CONECT   27   26   18   18   61                                       
CONECT   28   29   26   62   63                                       
CONECT   29   32   30   28   31                                       
CONECT   30   29   64   65   66                                       
CONECT   31   29   67   68   69                                       
CONECT   32   29   70   71   72                                       
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    6                                                      
CONECT   39    6                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   12                                                      
CONECT   45   13                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   22                                                      
CONECT   54   22                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   23                                                      
CONECT   59   24                                                      
CONECT   60   24                                                      
CONECT   61   27                                                      
CONECT   62   28                                                      
CONECT   63   28                                                      
CONECT   64   30                                                      
CONECT   65   30                                                      
CONECT   66   30                                                      
CONECT   67   31                                                      
CONECT   68   31                                                      
CONECT   69   31                                                      
CONECT   70   32                                                      
CONECT   71   32                                                      
CONECT   72   32                                                      
MASTER        0    0    0    0    0    0    0    0   72    0   72    0
END
