COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.466   2.564  -0.111  1.00  0.00           C  
HETATM    2  N   UNL     1      -0.492   1.646  -0.099  1.00  0.00           N  
HETATM    3  O   UNL     1       4.328   1.518  -0.304  1.00  0.00           O  
HETATM    4  C   UNL     1      -1.053   4.292   0.015  1.00  0.00           C  
HETATM    5  N   UNL     1       0.202   3.860  -0.056  1.00  0.00           N  
HETATM    6  O   UNL     1       7.554  -2.399   1.818  1.00  0.00           O  
HETATM    7  C   UNL     1      -2.099   3.356   0.031  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.773   1.990  -0.030  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.997   5.328   0.137  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.961   6.820   0.095  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.415   7.650  -1.108  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.302   7.567   1.387  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.406  -0.394  -0.082  1.00  0.00           C  
HETATM   14  C   UNL     1       2.107   0.724  -0.235  1.00  0.00           C  
HETATM   15  C   UNL     1       3.602   0.547  -0.303  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.660  -1.230  -0.054  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.182  -1.648   1.157  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.329  -2.415   1.189  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.962  -2.767  -0.002  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.431  -2.342  -1.219  1.00  0.00           C  
HETATM   21  C   UNL     1      -4.286  -1.572  -1.238  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.195  -3.591   0.026  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.821  -3.938  -1.169  1.00  0.00           C  
HETATM   24  C   UNL     1      -8.971  -4.708  -1.128  1.00  0.00           C  
HETATM   25  C   UNL     1      -9.457  -5.105   0.109  1.00  0.00           C  
HETATM   26  C   UNL     1      -8.785  -4.724   1.256  1.00  0.00           C  
HETATM   27  C   UNL     1       5.585  -0.864  -0.427  1.00  0.00           C  
HETATM   28  C   UNL     1       5.919  -2.356  -0.486  1.00  0.00           C  
HETATM   29  C   UNL     1       7.414  -2.533  -0.554  1.00  0.00           C  
HETATM   30  C   UNL     1       8.165  -2.547   0.613  1.00  0.00           C  
HETATM   31  C   UNL     1       9.541  -2.711   0.547  1.00  0.00           C  
HETATM   32  C   UNL     1      10.160  -2.860  -0.679  1.00  0.00           C  
HETATM   33  C   UNL     1       9.409  -2.846  -1.840  1.00  0.00           C  
HETATM   34  C   UNL     1       8.037  -2.688  -1.776  1.00  0.00           C  
HETATM   35  C   UNL     1       8.390  -2.423   2.977  1.00  0.00           C  
HETATM   36  N   UNL     1      -1.648   5.527   0.083  1.00  0.00           N  
HETATM   37  N   UNL     1      -3.259   4.054   0.106  1.00  0.00           N  
HETATM   38  N   UNL     1      -2.764   1.025  -0.018  1.00  0.00           N  
HETATM   39  N   UNL     1       1.786   2.153  -0.179  1.00  0.00           N  
HETATM   40  N   UNL     1      -7.690  -3.996   1.188  1.00  0.00           N  
HETATM   41  N   UNL     1       4.131  -0.691  -0.362  1.00  0.00           N  
HETATM   42  H   UNL     1      -3.737   6.112   0.197  1.00  0.00           H  
HETATM   43  H   UNL     1       0.116   6.661   0.041  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.904   8.613  -1.099  1.00  0.00           H  
HETATM   45  H   UNL     1      -1.172   7.119  -2.028  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.491   7.810  -1.054  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.979   6.976   2.244  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.791   8.529   1.396  1.00  0.00           H  
HETATM   49  H   UNL     1      -2.379   7.726   1.441  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.780  -0.650   0.773  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.860  -0.590  -1.004  1.00  0.00           H  
HETATM   52  H   UNL     1       1.648   0.283  -1.120  1.00  0.00           H  
HETATM   53  H   UNL     1       1.722   0.230   0.658  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.691  -1.375   2.079  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.736  -2.741   2.135  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.918  -2.613  -2.145  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.877  -1.239  -2.181  1.00  0.00           H  
HETATM   58  H   UNL     1      -7.415  -3.611  -2.115  1.00  0.00           H  
HETATM   59  H   UNL     1      -9.478  -4.992  -2.038  1.00  0.00           H  
HETATM   60  H   UNL     1     -10.352  -5.706   0.176  1.00  0.00           H  
HETATM   61  H   UNL     1      -9.162  -5.032   2.221  1.00  0.00           H  
HETATM   62  H   UNL     1       6.043  -0.423   0.458  1.00  0.00           H  
HETATM   63  H   UNL     1       5.969  -0.370  -1.320  1.00  0.00           H  
HETATM   64  H   UNL     1       5.535  -2.849   0.407  1.00  0.00           H  
HETATM   65  H   UNL     1       5.460  -2.796  -1.371  1.00  0.00           H  
HETATM   66  H   UNL     1      10.128  -2.721   1.454  1.00  0.00           H  
HETATM   67  H   UNL     1      11.231  -2.987  -0.730  1.00  0.00           H  
HETATM   68  H   UNL     1       9.895  -2.963  -2.797  1.00  0.00           H  
HETATM   69  H   UNL     1       7.453  -2.678  -2.685  1.00  0.00           H  
HETATM   70  H   UNL     1       9.118  -1.614   2.916  1.00  0.00           H  
HETATM   71  H   UNL     1       7.777  -2.295   3.869  1.00  0.00           H  
HETATM   72  H   UNL     1       8.912  -3.378   3.028  1.00  0.00           H  
HETATM   73  H   UNL     1      -3.697   1.288   0.033  1.00  0.00           H  
HETATM   74  H   UNL     1       2.500   2.810  -0.189  1.00  0.00           H  
HETATM   75  H   UNL     1       3.550  -1.468  -0.361  1.00  0.00           H  
CONECT    1   39    2    2    5                                       
CONECT    2    1    1    8                                            
CONECT    3   15   15                                                 
CONECT    4    5    5    7   36                                       
CONECT    5    1    4    4                                            
CONECT    6   30   35                                                 
CONECT    7    8    8    4   37                                       
CONECT    8    2   38    7    7                                       
CONECT    9   36   37   37   42                                       
CONECT   10   12   36   11   43                                       
CONECT   11   10   44   45   46                                       
CONECT   12   10   47   48   49                                       
CONECT   13   38   16   50   51                                       
CONECT   14   39   15   52   53                                       
CONECT   15    3    3   14   41                                       
CONECT   16   17   13   21   21                                       
CONECT   17   18   18   16   54                                       
CONECT   18   17   17   19   55                                       
CONECT   19   18   22   20   20                                       
CONECT   20   19   19   21   56                                       
CONECT   21   16   16   20   57                                       
CONECT   22   40   19   23   23                                       
CONECT   23   22   22   24   58                                       
CONECT   24   25   25   23   59                                       
CONECT   25   26   24   24   60                                       
CONECT   26   40   40   25   61                                       
CONECT   27   28   41   62   63                                       
CONECT   28   29   27   64   65                                       
CONECT   29   34   34   30   28                                       
CONECT   30   31   31   29    6                                       
CONECT   31   32   30   30   66                                       
CONECT   32   33   33   31   67                                       
CONECT   33   32   32   34   68                                       
CONECT   34   33   29   29   69                                       
CONECT   35    6   70   71   72                                       
CONECT   36    4   10    9                                            
CONECT   37    7    9    9                                            
CONECT   38   13    8   73                                            
CONECT   39   14    1   74                                            
CONECT   40   26   26   22                                            
CONECT   41   15   27   75                                            
CONECT   42    9                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   12                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   13                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   17                                                      
CONECT   55   18                                                      
CONECT   56   20                                                      
CONECT   57   21                                                      
CONECT   58   23                                                      
CONECT   59   24                                                      
CONECT   60   25                                                      
CONECT   61   26                                                      
CONECT   62   27                                                      
CONECT   63   27                                                      
CONECT   64   28                                                      
CONECT   65   28                                                      
CONECT   66   31                                                      
CONECT   67   32                                                      
CONECT   68   33                                                      
CONECT   69   34                                                      
CONECT   70   35                                                      
CONECT   71   35                                                      
CONECT   72   35                                                      
CONECT   73   38                                                      
CONECT   74   39                                                      
CONECT   75   41                                                      
MASTER        0    0    0    0    0    0    0    0   75    0   75    0
END
