COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.683  -1.652   0.199  1.00  0.00           C  
HETATM    2  C   UNL     1       2.772  -2.766  -0.567  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.808  -1.972   1.620  1.00  0.00           C  
HETATM    4  C   UNL     1       3.624   0.513  -0.119  1.00  0.00           C  
HETATM    5  C   UNL     1       4.794   1.416  -0.141  1.00  0.00           C  
HETATM    6  C   UNL     1       4.666   2.749  -0.547  1.00  0.00           C  
HETATM    7  C   UNL     1       6.914   3.053  -0.180  1.00  0.00           C  
HETATM    8  C   UNL     1       6.060   0.964   0.249  1.00  0.00           C  
HETATM    9  C   UNL     1       8.106   3.974  -0.202  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.283   0.051   0.378  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.222   0.661  -0.668  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.108  -0.652   0.378  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.095  -1.211   1.383  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.286  -1.642  -0.775  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.363   1.732  -0.135  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.799   1.651   0.317  1.00  0.00           C  
HETATM   17  N   UNL     1       1.723  -3.639  -0.646  1.00  0.00           N  
HETATM   18  C   UNL     1       0.567  -3.400   0.049  1.00  0.00           C  
HETATM   19  C   UNL     1       0.458  -2.246   0.851  1.00  0.00           C  
HETATM   20  C   UNL     1       1.505  -1.383   0.924  1.00  0.00           C  
HETATM   21  C   UNL     1       1.546  -4.812  -1.327  1.00  0.00           C  
HETATM   22  C   UNL     1       0.304  -5.259  -1.038  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.276  -4.393  -0.204  1.00  0.00           N  
HETATM   24  C   UNL     1       1.409  -0.147   1.781  1.00  0.00           C  
HETATM   25  N   UNL     1       3.769  -0.768   0.275  1.00  0.00           N  
HETATM   26  O   UNL     1       2.532   0.925  -0.457  1.00  0.00           O  
HETATM   27  N   UNL     1       5.738   3.521  -0.551  1.00  0.00           N  
HETATM   28  N   UNL     1       7.078   1.805   0.215  1.00  0.00           N  
HETATM   29  N   UNL     1      -1.771  -1.284   0.750  1.00  0.00           N  
HETATM   30  N   UNL     1      -3.595   0.625  -0.142  1.00  0.00           N  
HETATM   31  O   UNL     1      -3.899   2.794  -0.493  1.00  0.00           O  
HETATM   32  C   UNL     1      -6.328   3.058   0.646  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.513   3.317  -0.306  1.00  0.00           C  
HETATM   34  C   UNL     1      -8.004   1.901  -0.696  1.00  0.00           C  
HETATM   35  C   UNL     1      -6.681   1.105  -0.824  1.00  0.00           C  
HETATM   36  H   UNL     1       3.677  -2.966  -1.120  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.237  -2.914   1.962  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.582  -1.343   2.481  1.00  0.00           H  
HETATM   39  H   UNL     1       3.707   3.140  -0.853  1.00  0.00           H  
HETATM   40  H   UNL     1       6.202  -0.057   0.574  1.00  0.00           H  
HETATM   41  H   UNL     1       8.592   3.915  -1.176  1.00  0.00           H  
HETATM   42  H   UNL     1       7.779   4.997  -0.020  1.00  0.00           H  
HETATM   43  H   UNL     1       8.811   3.674   0.574  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.279  -0.031  -0.038  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.260   0.689   1.262  1.00  0.00           H  
HETATM   46  H   UNL     1      -1.932   1.694  -0.863  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.168   0.083  -1.590  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.065  -0.489   0.872  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.046  -0.555   2.253  1.00  0.00           H  
HETATM   50  H   UNL     1      -3.404  -2.208   1.696  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.326  -1.809  -1.263  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.666  -2.587  -0.388  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.994  -1.234  -1.497  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.878   1.008   1.193  1.00  0.00           H  
HETATM   55  H   UNL     1       2.265  -5.292  -1.974  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.145  -6.164  -1.418  1.00  0.00           H  
HETATM   57  H   UNL     1       2.373   0.362   1.795  1.00  0.00           H  
HETATM   58  H   UNL     1       0.651   0.521   1.371  1.00  0.00           H  
HETATM   59  H   UNL     1       1.132  -0.430   2.797  1.00  0.00           H  
HETATM   60  H   UNL     1       4.624  -1.078   0.612  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.665   3.097   1.682  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.546   3.800   0.480  1.00  0.00           H  
HETATM   63  H   UNL     1      -8.303   3.866   0.208  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.182   3.865  -1.188  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.633   1.480   0.088  1.00  0.00           H  
HETATM   66  H   UNL     1      -8.537   1.925  -1.646  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.215   1.293  -1.791  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.863   0.039  -0.688  1.00  0.00           H  
CONECT    1    2    2   20   25                                       
CONECT    2   17    1    1   36                                       
CONECT    3   19   29   37   38                                       
CONECT    4   25   26   26    5                                       
CONECT    5    4    6    6    8                                       
CONECT    6    5    5   27   39                                       
CONECT    7   27   27   28    9                                       
CONECT    8    5   28   28   40                                       
CONECT    9    7   41   42   43                                       
CONECT   10   29   11   44   45                                       
CONECT   11   10   30   46   47                                       
CONECT   12   13   30   14   48                                       
CONECT   13   29   12   49   50                                       
CONECT   14   12   51   52   53                                       
CONECT   15   30   31   31   16                                       
CONECT   16   35   15   32   54                                       
CONECT   17   21   18    2                                            
CONECT   18   23   23   17   19                                       
CONECT   19   18    3   20   20                                       
CONECT   20   19   19    1   24                                       
CONECT   21   22   22   17   55                                       
CONECT   22   21   21   23   56                                       
CONECT   23   22   18   18                                            
CONECT   24   20   57   58   59                                       
CONECT   25    1    4   60                                            
CONECT   26    4    4                                                 
CONECT   27    6    7    7                                            
CONECT   28    8    8    7                                            
CONECT   29    3   13   10                                            
CONECT   30   12   11   15                                            
CONECT   31   15   15                                                 
CONECT   32   16   33   61   62                                       
CONECT   33   34   32   63   64                                       
CONECT   34   35   33   65   66                                       
CONECT   35   16   34   67   68                                       
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    6                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   11                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   16                                                      
CONECT   55   21                                                      
CONECT   56   22                                                      
CONECT   57   24                                                      
CONECT   58   24                                                      
CONECT   59   24                                                      
CONECT   60   25                                                      
CONECT   61   32                                                      
CONECT   62   32                                                      
CONECT   63   33                                                      
CONECT   64   33                                                      
CONECT   65   34                                                      
CONECT   66   34                                                      
CONECT   67   35                                                      
CONECT   68   35                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
