COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.750   1.893   1.132  1.00  0.00           O  
HETATM    2  C   UNL     1       3.345   1.013   0.398  1.00  0.00           C  
HETATM    3  N   UNL     1       4.218   0.287  -0.328  1.00  0.00           N  
HETATM    4  C   UNL     1       5.655   0.559  -0.233  1.00  0.00           C  
HETATM    5  C   UNL     1       6.347   0.103  -1.519  1.00  0.00           C  
HETATM    6  C   UNL     1       7.847   0.387  -1.419  1.00  0.00           C  
HETATM    7  C   UNL     1       8.432  -0.373  -0.228  1.00  0.00           C  
HETATM    8  N   UNL     1       9.872  -0.101  -0.132  1.00  0.00           N  
HETATM    9  C   UNL     1       7.740   0.083   1.058  1.00  0.00           C  
HETATM   10  C   UNL     1       6.240  -0.201   0.959  1.00  0.00           C  
HETATM   11  C   UNL     1       1.893   0.734   0.306  1.00  0.00           C  
HETATM   12  C   UNL     1       0.973   1.471   1.056  1.00  0.00           C  
HETATM   13  C   UNL     1       1.408  -0.270  -0.536  1.00  0.00           C  
HETATM   14  C   UNL     1       0.041  -0.500  -0.594  1.00  0.00           C  
HETATM   15  O   UNL     1      -0.441  -1.472  -1.408  1.00  0.00           O  
HETATM   16  C   UNL     1      -1.365  -2.328  -0.902  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.977  -3.258  -1.733  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.915  -4.129  -1.222  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.249  -4.076   0.132  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.259  -5.005   0.684  1.00  0.00           C  
HETATM   21  N   UNL     1      -4.785  -6.002  -0.111  1.00  0.00           N  
HETATM   22  N   UNL     1      -4.652  -4.883   1.920  1.00  0.00           N  
HETATM   23  C   UNL     1      -2.632  -3.140   0.964  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.692  -2.276   0.448  1.00  0.00           C  
HETATM   25  N   UNL     1      -0.798   0.217   0.136  1.00  0.00           N  
HETATM   26  C   UNL     1      -0.379   1.179   0.941  1.00  0.00           C  
HETATM   27  O   UNL     1      -1.281   1.884   1.668  1.00  0.00           O  
HETATM   28  C   UNL     1      -2.397   2.332   1.038  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.407   2.946   1.770  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.540   3.403   1.133  1.00  0.00           C  
HETATM   31  C   UNL     1      -4.674   3.249  -0.247  1.00  0.00           C  
HETATM   32  C   UNL     1      -5.889   3.738  -0.934  1.00  0.00           C  
HETATM   33  N   UNL     1      -6.789   4.407  -0.269  1.00  0.00           N  
HETATM   34  N   UNL     1      -6.071   3.487  -2.276  1.00  0.00           N  
HETATM   35  C   UNL     1      -3.658   2.632  -0.979  1.00  0.00           C  
HETATM   36  C   UNL     1      -2.525   2.182  -0.337  1.00  0.00           C  
HETATM   37  H   UNL     1       3.896  -0.415  -0.914  1.00  0.00           H  
HETATM   38  H   UNL     1       5.813   1.629  -0.095  1.00  0.00           H  
HETATM   39  H   UNL     1       6.188  -0.967  -1.657  1.00  0.00           H  
HETATM   40  H   UNL     1       5.930   0.645  -2.368  1.00  0.00           H  
HETATM   41  H   UNL     1       8.340   0.062  -2.335  1.00  0.00           H  
HETATM   42  H   UNL     1       8.006   1.457  -1.281  1.00  0.00           H  
HETATM   43  H   UNL     1       8.273  -1.443  -0.366  1.00  0.00           H  
HETATM   44  H   UNL     1      10.282  -0.592   0.648  1.00  0.00           H  
HETATM   45  H   UNL     1      10.342  -0.334  -0.994  1.00  0.00           H  
HETATM   46  H   UNL     1       8.157  -0.458   1.907  1.00  0.00           H  
HETATM   47  H   UNL     1       7.899   1.153   1.196  1.00  0.00           H  
HETATM   48  H   UNL     1       5.747   0.124   1.875  1.00  0.00           H  
HETATM   49  H   UNL     1       6.081  -1.270   0.821  1.00  0.00           H  
HETATM   50  H   UNL     1       1.309   2.258   1.715  1.00  0.00           H  
HETATM   51  H   UNL     1       2.088  -0.858  -1.135  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.718  -3.299  -2.780  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.391  -4.851  -1.868  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.492  -6.093  -1.031  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.447  -6.611   0.251  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.230  -4.230   2.500  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.889  -3.096   2.012  1.00  0.00           H  
HETATM   58  H   UNL     1      -1.214  -1.552   1.091  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.303   3.065   2.838  1.00  0.00           H  
HETATM   60  H   UNL     1      -5.325   3.880   1.703  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.586   4.728  -0.719  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.440   2.925  -2.754  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.829   3.871  -2.744  1.00  0.00           H  
HETATM   64  H   UNL     1      -3.758   2.510  -2.047  1.00  0.00           H  
HETATM   65  H   UNL     1      -1.736   1.708  -0.903  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2   11    1    1    3                                       
CONECT    3    2    4   37                                            
CONECT    4    3    5   10   38                                       
CONECT    5    4    6   39   40                                       
CONECT    6    5    7   41   42                                       
CONECT    7    6    9    8   43                                       
CONECT    8    7   44   45                                            
CONECT    9   10    7   46   47                                       
CONECT   10    4    9   48   49                                       
CONECT   11   12   12   13    2                                       
CONECT   12   26   11   11   50                                       
CONECT   13   14   14   11   51                                       
CONECT   14   25   15   13   13                                       
CONECT   15   16   14                                                 
CONECT   16   24   24   17   15                                       
CONECT   17   18   18   16   52                                       
CONECT   18   19   17   17   53                                       
CONECT   19   20   23   23   18                                       
CONECT   20   22   22   21   19                                       
CONECT   21   20   54   55                                            
CONECT   22   20   20   56                                            
CONECT   23   19   19   24   57                                       
CONECT   24   23   16   16   58                                       
CONECT   25   26   26   14                                            
CONECT   26   27   25   25   12                                       
CONECT   27   26   28                                                 
CONECT   28   27   36   36   29                                       
CONECT   29   28   30   30   59                                       
CONECT   30   29   29   31   60                                       
CONECT   31   35   35   30   32                                       
CONECT   32   31   33   33   34                                       
CONECT   33   32   32   61                                            
CONECT   34   32   62   63                                            
CONECT   35   36   31   31   64                                       
CONECT   36   28   28   35   65                                       
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    5                                                      
CONECT   41    6                                                      
CONECT   42    6                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46    9                                                      
CONECT   47    9                                                      
CONECT   48   10                                                      
CONECT   49   10                                                      
CONECT   50   12                                                      
CONECT   51   13                                                      
CONECT   52   17                                                      
CONECT   53   18                                                      
CONECT   54   21                                                      
CONECT   55   21                                                      
CONECT   56   22                                                      
CONECT   57   23                                                      
CONECT   58   24                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
CONECT   61   33                                                      
CONECT   62   34                                                      
CONECT   63   34                                                      
CONECT   64   35                                                      
CONECT   65   36                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
