COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.987   2.217   1.030  1.00  0.00           C  
HETATM    2  C   UNL     1       6.098   0.723   1.338  1.00  0.00           C  
HETATM    3  N   UNL     1      -2.267  -2.216  -1.160  1.00  0.00           N  
HETATM    4  C   UNL     1       0.753  -0.368  -1.161  1.00  0.00           C  
HETATM    5  C   UNL     1       4.151   0.191   0.063  1.00  0.00           C  
HETATM    6  C   UNL     1       4.187  -1.242  -2.605  1.00  0.00           C  
HETATM    7  C   UNL     1       2.492  -2.749  -1.557  1.00  0.00           C  
HETATM    8  C   UNL     1       2.703  -1.416  -2.279  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.501  -2.005   2.473  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.215   1.059  -2.795  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.390   2.360  -2.056  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.527   3.539  -2.766  1.00  0.00           C  
HETATM   13  C   UNL     1       7.036   0.062   0.327  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.102  -1.335  -2.162  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.541   0.036  -1.879  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.622  -4.031   1.044  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.293  -4.514  -0.363  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.834  -3.546  -1.416  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.813  -2.519   1.091  1.00  0.00           C  
HETATM   20  C   UNL     1       2.241  -0.269  -1.377  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.691   4.738  -2.097  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.717   4.761  -0.716  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.578   3.580  -0.001  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.416   2.378  -0.675  1.00  0.00           C  
HETATM   25  C   UNL     1      -1.951  -0.252   3.999  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.459   1.182   4.164  1.00  0.00           C  
HETATM   27  C   UNL     1      -2.931   2.384   2.023  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.861   2.066   3.069  1.00  0.00           C  
HETATM   29  C   UNL     1       6.654   0.533   2.751  1.00  0.00           C  
HETATM   30  N   UNL     1       2.928  -0.355  -0.087  1.00  0.00           N  
HETATM   31  N   UNL     1      -1.913  -1.876   0.122  1.00  0.00           N  
HETATM   32  N   UNL     1      -0.097   0.034  -2.127  1.00  0.00           N  
HETATM   33  O   UNL     1       0.319  -0.810  -0.118  1.00  0.00           O  
HETATM   34  O   UNL     1       4.783   0.112   1.249  1.00  0.00           O  
HETATM   35  O   UNL     1       4.683   0.755  -0.873  1.00  0.00           O  
HETATM   36  O   UNL     1      -2.403  -1.643  -3.296  1.00  0.00           O  
HETATM   37  O   UNL     1      -2.219  -0.703   2.646  1.00  0.00           O  
HETATM   38  O   UNL     1      -2.505  -2.758   3.418  1.00  0.00           O  
HETATM   39  O   UNL     1      -2.600   3.603   1.357  1.00  0.00           O  
HETATM   40  H   UNL     1       5.591   2.352   0.023  1.00  0.00           H  
HETATM   41  H   UNL     1       5.318   2.688   1.750  1.00  0.00           H  
HETATM   42  H   UNL     1       6.974   2.676   1.096  1.00  0.00           H  
HETATM   43  H   UNL     1       4.481  -1.970  -3.361  1.00  0.00           H  
HETATM   44  H   UNL     1       4.360  -0.235  -2.984  1.00  0.00           H  
HETATM   45  H   UNL     1       4.778  -1.397  -1.702  1.00  0.00           H  
HETATM   46  H   UNL     1       3.070  -2.757  -0.633  1.00  0.00           H  
HETATM   47  H   UNL     1       1.434  -2.872  -1.324  1.00  0.00           H  
HETATM   48  H   UNL     1       2.821  -3.566  -2.199  1.00  0.00           H  
HETATM   49  H   UNL     1       2.124  -1.408  -3.203  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.190   0.682  -3.104  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.593   1.222  -3.676  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.506   3.524  -3.846  1.00  0.00           H  
HETATM   53  H   UNL     1       8.023   0.520   0.394  1.00  0.00           H  
HETATM   54  H   UNL     1       7.115  -1.003   0.547  1.00  0.00           H  
HETATM   55  H   UNL     1       6.640   0.197  -0.679  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.731   0.299  -0.839  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.539  -4.515   1.381  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.808  -4.307   1.714  1.00  0.00           H  
HETATM   59  H   UNL     1      -1.211  -4.593  -0.471  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.739  -5.497  -0.518  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.921  -3.501  -1.348  1.00  0.00           H  
HETATM   62  H   UNL     1      -2.540  -3.884  -2.410  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.845  -2.270   0.840  1.00  0.00           H  
HETATM   64  H   UNL     1       2.477   0.683  -1.852  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.798   5.657  -2.654  1.00  0.00           H  
HETATM   66  H   UNL     1      -2.844   5.697  -0.194  1.00  0.00           H  
HETATM   67  H   UNL     1      -2.310   1.458  -0.120  1.00  0.00           H  
HETATM   68  H   UNL     1      -0.878  -0.283   4.187  1.00  0.00           H  
HETATM   69  H   UNL     1      -2.463  -0.904   4.708  1.00  0.00           H  
HETATM   70  H   UNL     1      -3.546   1.193   4.087  1.00  0.00           H  
HETATM   71  H   UNL     1      -2.161   1.562   5.141  1.00  0.00           H  
HETATM   72  H   UNL     1      -2.979   1.574   1.294  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.898   2.488   2.513  1.00  0.00           H  
HETATM   74  H   UNL     1      -1.497   2.994   3.510  1.00  0.00           H  
HETATM   75  H   UNL     1      -1.032   1.542   2.593  1.00  0.00           H  
HETATM   76  H   UNL     1       5.985   1.004   3.471  1.00  0.00           H  
HETATM   77  H   UNL     1       6.732  -0.532   2.970  1.00  0.00           H  
HETATM   78  H   UNL     1       7.641   0.992   2.817  1.00  0.00           H  
HETATM   79  H   UNL     1       2.503  -0.805   0.660  1.00  0.00           H  
HETATM   80  H   UNL     1      -1.908  -0.874   0.243  1.00  0.00           H  
HETATM   81  H   UNL     1       0.248   0.323  -2.987  1.00  0.00           H  
CONECT    1    2   40   41   42                                       
CONECT    2   29    1   13   34                                       
CONECT    3   14   31   18                                            
CONECT    4   32   20   33   33                                       
CONECT    5   35   35   34   30                                       
CONECT    6    8   43   44   45                                       
CONECT    7    8   46   47   48                                       
CONECT    8   20    6    7   49                                       
CONECT    9   37   19   38   38                                       
CONECT   10   11   15   50   51                                       
CONECT   11   12   12   24   10                                       
CONECT   12   21   11   11   52                                       
CONECT   13    2   53   54   55                                       
CONECT   14   15   36   36    3                                       
CONECT   15   10   32   14   56                                       
CONECT   16   19   17   57   58                                       
CONECT   17   16   18   59   60                                       
CONECT   18   17    3   61   62                                       
CONECT   19    9   16   31   63                                       
CONECT   20   30    4    8   64                                       
CONECT   21   22   22   12   65                                       
CONECT   22   21   21   23   66                                       
CONECT   23   22   39   24   24                                       
CONECT   24   23   23   11   67                                       
CONECT   25   26   37   68   69                                       
CONECT   26   28   25   70   71                                       
CONECT   27   39   28   72   73                                       
CONECT   28   27   26   74   75                                       
CONECT   29    2   76   77   78                                       
CONECT   30    5   20   79                                            
CONECT   31   19    3   80                                            
CONECT   32   15    4   81                                            
CONECT   33    4    4                                                 
CONECT   34    2    5                                                 
CONECT   35    5    5                                                 
CONECT   36   14   14                                                 
CONECT   37   25    9                                                 
CONECT   38    9    9                                                 
CONECT   39   27   23                                                 
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    1                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    6                                                      
CONECT   46    7                                                      
CONECT   47    7                                                      
CONECT   48    7                                                      
CONECT   49    8                                                      
CONECT   50   10                                                      
CONECT   51   10                                                      
CONECT   52   12                                                      
CONECT   53   13                                                      
CONECT   54   13                                                      
CONECT   55   13                                                      
CONECT   56   15                                                      
CONECT   57   16                                                      
CONECT   58   16                                                      
CONECT   59   17                                                      
CONECT   60   17                                                      
CONECT   61   18                                                      
CONECT   62   18                                                      
CONECT   63   19                                                      
CONECT   64   20                                                      
CONECT   65   21                                                      
CONECT   66   22                                                      
CONECT   67   24                                                      
CONECT   68   25                                                      
CONECT   69   25                                                      
CONECT   70   26                                                      
CONECT   71   26                                                      
CONECT   72   27                                                      
CONECT   73   27                                                      
CONECT   74   28                                                      
CONECT   75   28                                                      
CONECT   76   29                                                      
CONECT   77   29                                                      
CONECT   78   29                                                      
CONECT   79   30                                                      
CONECT   80   31                                                      
CONECT   81   32                                                      
MASTER        0    0    0    0    0    0    0    0   81    0   81    0
END
