COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.186   2.604   0.839  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.672  -4.085   0.451  1.00  0.00           C  
HETATM    3  C   UNL     1       1.974   1.523   0.449  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.189   3.352  -0.331  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.502   4.080  -0.467  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.459   0.402  -1.237  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.748   0.638  -0.762  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.445  -0.335  -0.114  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.860  -0.808  -1.066  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.550  -1.838  -0.401  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.861  -1.598   0.081  1.00  0.00           C  
HETATM   12  C   UNL     1       1.489   0.603  -0.469  1.00  0.00           C  
HETATM   13  N   UNL     1       8.335  -0.863  -0.912  1.00  0.00           N  
HETATM   14  C   UNL     1       5.273  -2.243   0.521  1.00  0.00           C  
HETATM   15  C   UNL     1       3.955  -2.070  -0.240  1.00  0.00           C  
HETATM   16  C   UNL     1       3.513  -0.607  -0.161  1.00  0.00           C  
HETATM   17  C   UNL     1       4.571   0.283  -0.818  1.00  0.00           C  
HETATM   18  C   UNL     1       5.896   0.137  -0.064  1.00  0.00           C  
HETATM   19  C   UNL     1       7.481  -1.715  -0.446  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.962  -3.097  -0.208  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.056  -5.414   0.664  1.00  0.00           C  
HETATM   22  N   UNL     1      -1.849  -5.649   0.232  1.00  0.00           N  
HETATM   23  N   UNL     1      -3.758  -6.402   1.320  1.00  0.00           N  
HETATM   24  C   UNL     1      -4.971  -3.835   0.925  1.00  0.00           C  
HETATM   25  C   UNL     1      -5.557  -2.624   0.747  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.717   1.504  -1.949  1.00  0.00           C  
HETATM   27  N   UNL     1      -1.854   2.207  -0.997  1.00  0.00           N  
HETATM   28  C   UNL     1      -3.898   4.673   0.887  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.357   5.205  -1.493  1.00  0.00           C  
HETATM   30  C   UNL     1      -1.173   3.733   0.464  1.00  0.00           C  
HETATM   31  C   UNL     1      -0.105   2.752   0.291  1.00  0.00           C  
HETATM   32  C   UNL     1       1.695   3.580   1.818  1.00  0.00           C  
HETATM   33  O   UNL     1       2.927   3.429   2.342  1.00  0.00           O  
HETATM   34  O   UNL     1       1.003   4.521   2.153  1.00  0.00           O  
HETATM   35  C   UNL     1      -0.583   1.812  -0.639  1.00  0.00           C  
HETATM   36  C   UNL     1       0.223   0.743  -1.011  1.00  0.00           C  
HETATM   37  O   UNL     1       2.267  -0.448  -0.842  1.00  0.00           O  
HETATM   38  N   UNL     1       6.255  -1.287  -0.010  1.00  0.00           N  
HETATM   39  C   UNL     1       7.834  -3.178  -0.384  1.00  0.00           C  
HETATM   40  H   UNL     1       2.964   1.401   0.863  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.271   3.383  -0.798  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.200   1.607  -0.911  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.444  -0.137   0.248  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.861  -0.977  -1.439  1.00  0.00           H  
HETATM   45  H   UNL     1       5.112  -2.049   1.582  1.00  0.00           H  
HETATM   46  H   UNL     1       5.642  -3.260   0.387  1.00  0.00           H  
HETATM   47  H   UNL     1       4.097  -2.351  -1.283  1.00  0.00           H  
HETATM   48  H   UNL     1       3.191  -2.705   0.208  1.00  0.00           H  
HETATM   49  H   UNL     1       3.395  -0.319   0.884  1.00  0.00           H  
HETATM   50  H   UNL     1       4.707  -0.020  -1.856  1.00  0.00           H  
HETATM   51  H   UNL     1       4.244   1.323  -0.783  1.00  0.00           H  
HETATM   52  H   UNL     1       6.676   0.691  -0.586  1.00  0.00           H  
HETATM   53  H   UNL     1       5.785   0.525   0.949  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.964  -3.294  -0.570  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.446  -6.520   0.371  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.656  -6.227   1.642  1.00  0.00           H  
HETATM   57  H   UNL     1      -3.354  -7.273   1.459  1.00  0.00           H  
HETATM   58  H   UNL     1      -5.511  -4.618   1.438  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.556  -2.447   1.117  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.107   1.075  -2.745  1.00  0.00           H  
HETATM   61  H   UNL     1      -3.433   2.205  -2.378  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.129   5.370   1.218  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.848   5.199   0.789  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.001   3.871   1.618  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.534   5.858  -1.203  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.153   4.777  -2.475  1.00  0.00           H  
HETATM   67  H   UNL     1      -4.281   5.782  -1.533  1.00  0.00           H  
HETATM   68  H   UNL     1      -1.151   4.600   1.108  1.00  0.00           H  
HETATM   69  H   UNL     1       3.217   4.095   2.980  1.00  0.00           H  
HETATM   70  H   UNL     1      -0.140   0.019  -1.725  1.00  0.00           H  
HETATM   71  H   UNL     1       8.842  -3.326  -0.772  1.00  0.00           H  
HETATM   72  H   UNL     1       7.788  -3.520   0.650  1.00  0.00           H  
HETATM   73  H   UNL     1       7.126  -3.749  -0.986  1.00  0.00           H  
HETATM   74  H   UNL     1       9.203  -1.166  -1.220  1.00  0.00           H  
CONECT    1    3    3   31   32                                       
CONECT    2   20   20   24   21                                       
CONECT    3    1    1   12   40                                       
CONECT    4   27    5   30   30                                       
CONECT    5    4   28   41   29                                       
CONECT    6   26    7    7    9                                       
CONECT    7    6    6   42    8                                       
CONECT    8    7   43   11   11                                       
CONECT    9    6   44   10   10                                       
CONECT   10    9    9   11   20                                       
CONECT   11   10    8    8   25                                       
CONECT   12    3   37   36   36                                       
CONECT   13   19   19   74                                            
CONECT   14   15   45   46   38                                       
CONECT   15   14   47   48   16                                       
CONECT   16   15   37   49   17                                       
CONECT   17   16   50   51   18                                       
CONECT   18   38   17   52   53                                       
CONECT   19   13   13   38   39                                       
CONECT   20    2    2   10   54                                       
CONECT   21    2   22   22   23                                       
CONECT   22   21   21   55                                            
CONECT   23   21   56   57                                            
CONECT   24    2   25   25   58                                       
CONECT   25   24   24   11   59                                       
CONECT   26    6   60   61   27                                       
CONECT   27    4   26   35                                            
CONECT   28    5   62   63   64                                       
CONECT   29    5   65   66   67                                       
CONECT   30    4    4   68   31                                       
CONECT   31    1   30   35   35                                       
CONECT   32   33    1   34   34                                       
CONECT   33   32   69                                                 
CONECT   34   32   32                                                 
CONECT   35   31   31   36   27                                       
CONECT   36   12   12   35   70                                       
CONECT   37   12   16                                                 
CONECT   38   18   19   14                                            
CONECT   39   19   71   72   73                                       
CONECT   40    3                                                      
CONECT   41    5                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45   14                                                      
CONECT   46   14                                                      
CONECT   47   15                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   17                                                      
CONECT   52   18                                                      
CONECT   53   18                                                      
CONECT   54   20                                                      
CONECT   55   22                                                      
CONECT   56   23                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   25                                                      
CONECT   60   26                                                      
CONECT   61   26                                                      
CONECT   62   28                                                      
CONECT   63   28                                                      
CONECT   64   28                                                      
CONECT   65   29                                                      
CONECT   66   29                                                      
CONECT   67   29                                                      
CONECT   68   30                                                      
CONECT   69   33                                                      
CONECT   70   36                                                      
CONECT   71   39                                                      
CONECT   72   39                                                      
CONECT   73   39                                                      
CONECT   74   13                                                      
MASTER        0    0    0    0    0    0    0    0   74    0   74    0
END
