COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.671  -1.085  -0.684  1.00  0.00           C  
HETATM    2  C   UNL     1       4.781   0.588   4.303  1.00  0.00           C  
HETATM    3  C   UNL     1       3.330  -2.776  -0.717  1.00  0.00           C  
HETATM    4  C   UNL     1       2.083  -3.569  -0.734  1.00  0.00           C  
HETATM    5  C   UNL     1       5.729   0.774   3.117  1.00  0.00           C  
HETATM    6  C   UNL     1       5.194   0.329  -0.668  1.00  0.00           C  
HETATM    7  C   UNL     1       4.599  -3.259  -0.706  1.00  0.00           C  
HETATM    8  C   UNL     1       5.006   0.396   1.822  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.018  -4.095  -0.754  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.491  -3.971  -0.767  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.987   0.149   4.266  1.00  0.00           C  
HETATM   12  C   UNL     1       0.697  -5.250  -0.762  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.938  -0.108   3.095  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.483  -3.124  -0.776  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.220   0.197   1.779  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.608  -4.480  -0.805  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.584  -2.141  -0.767  1.00  0.00           C  
HETATM   18  C   UNL     1       5.953   0.582   0.636  1.00  0.00           C  
HETATM   19  C   UNL     1       4.358   2.585  -0.851  1.00  0.00           C  
HETATM   20  C   UNL     1       3.260   3.568  -0.929  1.00  0.00           C  
HETATM   21  C   UNL     1       3.389   4.920  -1.028  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.171  -0.060   0.608  1.00  0.00           C  
HETATM   23  C   UNL     1       1.270   4.417  -1.001  1.00  0.00           C  
HETATM   24  C   UNL     1      -0.202   4.541  -1.021  1.00  0.00           C  
HETATM   25  C   UNL     1       5.008  -4.709  -0.719  1.00  0.00           C  
HETATM   26  C   UNL     1      -0.922   5.689  -1.119  1.00  0.00           C  
HETATM   27  C   UNL     1       0.137  -6.649  -0.781  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.302   4.008  -0.995  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.548   3.216  -0.938  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.417   0.122  -0.711  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.817   3.697  -0.990  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.891   1.531  -0.803  1.00  0.00           C  
HETATM   33  N   UNL     1       5.476   0.950   5.546  1.00  0.00           N  
HETATM   34  N   UNL     1      -5.677  -0.144   5.530  1.00  0.00           N  
HETATM   35  N   UNL     1       3.415  -1.420  -0.701  1.00  0.00           N  
HETATM   36  N   UNL     1      -4.268  -0.812  -0.737  1.00  0.00           N  
HETATM   37  N   UNL     1       0.871  -3.069  -0.734  1.00  0.00           N  
HETATM   38  N   UNL     1      -1.089   3.514  -0.944  1.00  0.00           N  
HETATM   39  N   UNL     1      -2.154  -2.841  -0.754  1.00  0.00           N  
HETATM   40  N   UNL     1       1.930   3.289  -0.915  1.00  0.00           N  
HETATM   41  N   UNL     1       4.044   1.258  -0.762  1.00  0.00           N  
HETATM   42  N   UNL     1      -3.634   1.865  -0.822  1.00  0.00           N  
HETATM   43  O   UNL     1      -2.365  -4.992  -0.798  1.00  0.00           O  
HETATM   44  O   UNL     1       2.147   5.434  -1.069  1.00  0.00           O  
HETATM   45  O   UNL     1       2.000  -4.910  -0.752  1.00  0.00           O  
HETATM   46  O   UNL     1       5.423  -2.194  -0.688  1.00  0.00           O  
HETATM   47  O   UNL     1      -2.224   5.345  -1.105  1.00  0.00           O  
HETATM   48  O   UNL     1      -5.642   2.637  -0.902  1.00  0.00           O  
HETATM   49  O   UNL     1       5.518   2.949  -0.866  1.00  0.00           O  
HETATM   50  O   UNL     1      -5.744  -2.505  -0.786  1.00  0.00           O  
HETATM   51  H   UNL     1       3.908   1.228   4.175  1.00  0.00           H  
HETATM   52  H   UNL     1       4.463  -0.454   4.355  1.00  0.00           H  
HETATM   53  H   UNL     1       6.047   1.815   3.065  1.00  0.00           H  
HETATM   54  H   UNL     1       6.602   0.133   3.245  1.00  0.00           H  
HETATM   55  H   UNL     1       5.861   0.482  -1.516  1.00  0.00           H  
HETATM   56  H   UNL     1       4.688  -0.645   1.874  1.00  0.00           H  
HETATM   57  H   UNL     1       4.133   1.037   1.694  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.113  -0.494   4.171  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.674   1.193   4.257  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.252  -1.152   3.104  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.813   0.535   3.189  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.906   1.241   1.770  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.345  -0.446   1.684  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.531  -5.039  -0.830  1.00  0.00           H  
HETATM   65  H   UNL     1       6.780  -0.123   0.717  1.00  0.00           H  
HETATM   66  H   UNL     1       6.343   1.600   0.638  1.00  0.00           H  
HETATM   67  H   UNL     1       4.314   5.475  -1.065  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.555  -1.078   0.669  1.00  0.00           H  
HETATM   69  H   UNL     1      -7.001   0.645   0.652  1.00  0.00           H  
HETATM   70  H   UNL     1       5.120  -5.046  -1.750  1.00  0.00           H  
HETATM   71  H   UNL     1       5.956  -4.825  -0.194  1.00  0.00           H  
HETATM   72  H   UNL     1       4.243  -5.307  -0.223  1.00  0.00           H  
HETATM   73  H   UNL     1      -0.524   6.691  -1.194  1.00  0.00           H  
HETATM   74  H   UNL     1       0.008  -6.975  -1.814  1.00  0.00           H  
HETATM   75  H   UNL     1       0.826  -7.323  -0.271  1.00  0.00           H  
HETATM   76  H   UNL     1      -0.827  -6.662  -0.273  1.00  0.00           H  
HETATM   77  H   UNL     1      -6.086  -0.074  -1.549  1.00  0.00           H  
HETATM   78  H   UNL     1      -5.109   4.733  -1.084  1.00  0.00           H  
HETATM   79  H   UNL     1       4.870   0.836   6.345  1.00  0.00           H  
HETATM   80  H   UNL     1       6.324   0.414   5.656  1.00  0.00           H  
HETATM   81  H   UNL     1      -5.069   0.018   6.319  1.00  0.00           H  
HETATM   82  H   UNL     1      -6.527   0.394   5.611  1.00  0.00           H  
HETATM   83  H   UNL     1      -3.350  -0.500  -0.733  1.00  0.00           H  
HETATM   84  H   UNL     1       3.126   0.944  -0.760  1.00  0.00           H  
CONECT    1   35   35   46    6                                       
CONECT    2    5   33   51   52                                       
CONECT    3    4   35    7    7                                       
CONECT    4   37   37   45    3                                       
CONECT    5    8    2   53   54                                       
CONECT    6    1   41   18   55                                       
CONECT    7    3    3   25   46                                       
CONECT    8   18    5   56   57                                       
CONECT    9   10   12   12   37                                       
CONECT   10   43   39   39    9                                       
CONECT   11   34   13   58   59                                       
CONECT   12   27    9    9   45                                       
CONECT   13   11   15   60   61                                       
CONECT   14   16   16   17   39                                       
CONECT   15   13   22   62   63                                       
CONECT   16   43   14   14   64                                       
CONECT   17   50   50   14   36                                       
CONECT   18    6    8   65   66                                       
CONECT   19   20   41   49   49                                       
CONECT   20   40   21   21   19                                       
CONECT   21   44   20   20   67                                       
CONECT   22   30   15   68   69                                       
CONECT   23   24   40   40   44                                       
CONECT   24   38   26   26   23                                       
CONECT   25    7   70   71   72                                       
CONECT   26   47   24   24   73                                       
CONECT   27   12   74   75   76                                       
CONECT   28   29   47   38   38                                       
CONECT   29   31   31   42   28                                       
CONECT   30   32   36   22   77                                       
CONECT   31   48   29   29   78                                       
CONECT   32   48   30   42   42                                       
CONECT   33    2   79   80                                            
CONECT   34   11   81   82                                            
CONECT   35    3    1    1                                            
CONECT   36   17   30   83                                            
CONECT   37    9    4    4                                            
CONECT   38   28   28   24                                            
CONECT   39   14   10   10                                            
CONECT   40   23   23   20                                            
CONECT   41   19    6   84                                            
CONECT   42   32   32   29                                            
CONECT   43   16   10                                                 
CONECT   44   23   21                                                 
CONECT   45   12    4                                                 
CONECT   46    7    1                                                 
CONECT   47   28   26                                                 
CONECT   48   32   31                                                 
CONECT   49   19   19                                                 
CONECT   50   17   17                                                 
CONECT   51    2                                                      
CONECT   52    2                                                      
CONECT   53    5                                                      
CONECT   54    5                                                      
CONECT   55    6                                                      
CONECT   56    8                                                      
CONECT   57    8                                                      
CONECT   58   11                                                      
CONECT   59   11                                                      
CONECT   60   13                                                      
CONECT   61   13                                                      
CONECT   62   15                                                      
CONECT   63   15                                                      
CONECT   64   16                                                      
CONECT   65   18                                                      
CONECT   66   18                                                      
CONECT   67   21                                                      
CONECT   68   22                                                      
CONECT   69   22                                                      
CONECT   70   25                                                      
CONECT   71   25                                                      
CONECT   72   25                                                      
CONECT   73   26                                                      
CONECT   74   27                                                      
CONECT   75   27                                                      
CONECT   76   27                                                      
CONECT   77   30                                                      
CONECT   78   31                                                      
CONECT   79   33                                                      
CONECT   80   33                                                      
CONECT   81   34                                                      
CONECT   82   34                                                      
CONECT   83   36                                                      
CONECT   84   41                                                      
MASTER        0    0    0    0    0    0    0    0   84    0   84    0
END
