COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.065  -1.262  -1.290  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.853  -7.232  -0.811  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.508  -6.576   1.925  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.754  -1.913   0.939  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.991   3.627  -0.868  1.00  0.00           C  
HETATM    6  C   UNL     1       0.215   3.666   0.312  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.121   2.070  -1.449  1.00  0.00           C  
HETATM    8  C   UNL     1       1.981   2.152  -0.287  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.339   3.448  -0.090  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.883   5.319   0.143  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.840   6.781   0.591  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.961   2.848   0.023  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.352   0.485   0.469  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.393  -0.928   0.036  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.095  -2.552  -1.711  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.453  -3.577  -0.817  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.826  -5.794  -0.362  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.143  -5.477   0.961  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.781  -3.255   0.525  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.592   3.106  -0.662  1.00  0.00           C  
HETATM   21  C   UNL     1       1.498   3.198   0.503  1.00  0.00           C  
HETATM   22  C   UNL     1       1.158   1.587  -1.266  1.00  0.00           C  
HETATM   23  C   UNL     1       3.312   1.661  -0.095  1.00  0.00           C  
HETATM   24  C   UNL     1       4.404   1.258   0.062  1.00  0.00           C  
HETATM   25  C   UNL     1       5.735   0.766   0.254  1.00  0.00           C  
HETATM   26  C   UNL     1       6.555   1.338   1.246  1.00  0.00           C  
HETATM   27  C   UNL     1       7.818   0.885   1.449  1.00  0.00           C  
HETATM   28  C   UNL     1       6.206  -0.272  -0.535  1.00  0.00           C  
HETATM   29  C   UNL     1       7.511  -0.749  -0.342  1.00  0.00           C  
HETATM   30  C   UNL     1       8.325  -0.168   0.665  1.00  0.00           C  
HETATM   31  C   UNL     1      10.020  -1.609   0.107  1.00  0.00           C  
HETATM   32  C   UNL     1       9.220  -2.178  -0.886  1.00  0.00           C  
HETATM   33  N   UNL     1      -4.543   4.736   0.253  1.00  0.00           N  
HETATM   34  N   UNL     1      -3.002   1.448  -0.406  1.00  0.00           N  
HETATM   35  N   UNL     1      -3.489  -4.854  -1.215  1.00  0.00           N  
HETATM   36  N   UNL     1      -4.125  -4.230   1.374  1.00  0.00           N  
HETATM   37  N   UNL     1       9.568  -0.625   0.852  1.00  0.00           N  
HETATM   38  N   UNL     1       7.995  -1.750  -1.087  1.00  0.00           N  
HETATM   39  O   UNL     1      -5.264   2.773  -0.489  1.00  0.00           O  
HETATM   40  O   UNL     1      -3.635   0.778   1.615  1.00  0.00           O  
HETATM   41  H   UNL     1      -2.790  -0.481  -1.984  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.849  -7.479  -1.179  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.124  -7.378  -1.608  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.606  -7.880   0.031  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.607  -6.942   2.418  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.200  -6.189   2.673  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.982  -7.393   1.381  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.013  -1.652   1.955  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.276   3.500  -1.913  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.027   4.684  -0.607  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.160   4.475   0.922  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.756   1.637  -2.208  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.574   4.765   0.778  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.218   5.266  -0.892  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.149   7.336  -0.043  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.837   7.215   0.510  1.00  0.00           H  
HETATM   57  H   UNL     1      -5.505   6.834   1.627  1.00  0.00           H  
HETATM   58  H   UNL     1      -2.625   2.901   1.059  1.00  0.00           H  
HETATM   59  H   UNL     1      -2.845  -2.791  -2.734  1.00  0.00           H  
HETATM   60  H   UNL     1       2.128   3.640   1.261  1.00  0.00           H  
HETATM   61  H   UNL     1       1.525   0.778  -1.880  1.00  0.00           H  
HETATM   62  H   UNL     1       6.174   2.146   1.852  1.00  0.00           H  
HETATM   63  H   UNL     1       8.435   1.333   2.214  1.00  0.00           H  
HETATM   64  H   UNL     1       5.573  -0.711  -1.292  1.00  0.00           H  
HETATM   65  H   UNL     1      11.025  -1.974   0.259  1.00  0.00           H  
HETATM   66  H   UNL     1       9.614  -2.979  -1.495  1.00  0.00           H  
HETATM   67  H   UNL     1      -3.804   5.276   0.573  1.00  0.00           H  
HETATM   68  H   UNL     1      -2.776   1.214  -1.320  1.00  0.00           H  
CONECT    1   14   15   15   41                                       
CONECT    2   17   42   43   44                                       
CONECT    3   18   45   46   47                                       
CONECT    4   14   14   19   48                                       
CONECT    5   20   12   49   50                                       
CONECT    6   20   20   21   51                                       
CONECT    7   22   22   20   52                                       
CONECT    8   22   23   21   21                                       
CONECT    9   33   12   39   39                                       
CONECT   10   11   33   53   54                                       
CONECT   11   10   55   56   57                                       
CONECT   12    5    9   34   58                                       
CONECT   13   40   40   34   14                                       
CONECT   14   13    4    4    1                                       
CONECT   15    1    1   16   59                                       
CONECT   16   19   15   35   35                                       
CONECT   17   18   18   35    2                                       
CONECT   18   36    3   17   17                                       
CONECT   19    4   36   36   16                                       
CONECT   20    7    5    6    6                                       
CONECT   21    8    8    6   60                                       
CONECT   22    7    7    8   61                                       
CONECT   23   24   24   24    8                                       
CONECT   24   25   23   23   23                                       
CONECT   25   26   26   28   24                                       
CONECT   26   27   25   25   62                                       
CONECT   27   30   30   26   63                                       
CONECT   28   29   29   25   64                                       
CONECT   29   30   38   28   28                                       
CONECT   30   37   27   27   29                                       
CONECT   31   37   37   32   65                                       
CONECT   32   31   38   38   66                                       
CONECT   33   10    9   67                                            
CONECT   34   12   13   68                                            
CONECT   35   16   16   17                                            
CONECT   36   19   19   18                                            
CONECT   37   31   31   30                                            
CONECT   38   32   32   29                                            
CONECT   39    9    9                                                 
CONECT   40   13   13                                                 
CONECT   41    1                                                      
CONECT   42    2                                                      
CONECT   43    2                                                      
CONECT   44    2                                                      
CONECT   45    3                                                      
CONECT   46    3                                                      
CONECT   47    3                                                      
CONECT   48    4                                                      
CONECT   49    5                                                      
CONECT   50    5                                                      
CONECT   51    6                                                      
CONECT   52    7                                                      
CONECT   53   10                                                      
CONECT   54   10                                                      
CONECT   55   11                                                      
CONECT   56   11                                                      
CONECT   57   11                                                      
CONECT   58   12                                                      
CONECT   59   15                                                      
CONECT   60   21                                                      
CONECT   61   22                                                      
CONECT   62   26                                                      
CONECT   63   27                                                      
CONECT   64   28                                                      
CONECT   65   31                                                      
CONECT   66   32                                                      
CONECT   67   33                                                      
CONECT   68   34                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
