COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      10.956  -0.475  -0.878  1.00  0.00           C  
HETATM    2  N   UNL     1       9.514  -0.195  -0.886  1.00  0.00           N  
HETATM    3  C   UNL     1       8.762  -1.284  -0.248  1.00  0.00           C  
HETATM    4  C   UNL     1       7.263  -0.993  -0.348  1.00  0.00           C  
HETATM    5  N   UNL     1       6.972   0.293   0.300  1.00  0.00           N  
HETATM    6  C   UNL     1       7.724   1.383  -0.338  1.00  0.00           C  
HETATM    7  C   UNL     1       9.223   1.092  -0.239  1.00  0.00           C  
HETATM    8  C   UNL     1       5.599   0.560   0.292  1.00  0.00           C  
HETATM    9  C   UNL     1       4.718  -0.351  -0.277  1.00  0.00           C  
HETATM   10  C   UNL     1       3.363  -0.088  -0.285  1.00  0.00           C  
HETATM   11  C   UNL     1       2.880   1.087   0.276  1.00  0.00           C  
HETATM   12  N   UNL     1       1.505   1.354   0.268  1.00  0.00           N  
HETATM   13  C   UNL     1       0.600   0.316   0.358  1.00  0.00           C  
HETATM   14  N   UNL     1       1.056  -0.918   0.535  1.00  0.00           N  
HETATM   15  C   UNL     1       0.228  -1.946   0.628  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.141  -1.709   0.537  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.339  -2.557   0.590  1.00  0.00           C  
HETATM   18  O   UNL     1      -2.365  -3.763   0.741  1.00  0.00           O  
HETATM   19  N   UNL     1      -3.406  -1.744   0.439  1.00  0.00           N  
HETATM   20  C   UNL     1      -4.805  -2.177   0.431  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.212  -2.539  -0.974  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.715  -3.722  -1.226  1.00  0.00           C  
HETATM   23  N   UNL     1      -2.967  -0.424   0.292  1.00  0.00           N  
HETATM   24  C   UNL     1      -1.592  -0.385   0.349  1.00  0.00           C  
HETATM   25  N   UNL     1      -0.696   0.587   0.271  1.00  0.00           N  
HETATM   26  C   UNL     1      -3.795   0.682   0.115  1.00  0.00           C  
HETATM   27  N   UNL     1      -5.100   0.508  -0.027  1.00  0.00           N  
HETATM   28  C   UNL     1      -5.919   1.528  -0.197  1.00  0.00           C  
HETATM   29  C   UNL     1      -5.439   2.823  -0.233  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.077   3.048  -0.088  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.244   1.958   0.094  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.397   1.278  -0.354  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.839   1.700  -1.756  1.00  0.00           C  
HETATM   34  C   UNL     1      -7.685  -0.211  -0.155  1.00  0.00           C  
HETATM   35  O   UNL     1      -8.115   2.037   0.621  1.00  0.00           O  
HETATM   36  C   UNL     1       3.760   1.997   0.846  1.00  0.00           C  
HETATM   37  C   UNL     1       5.115   1.732   0.859  1.00  0.00           C  
HETATM   38  H   UNL     1      11.150  -1.399  -1.422  1.00  0.00           H  
HETATM   39  H   UNL     1      11.488   0.348  -1.357  1.00  0.00           H  
HETATM   40  H   UNL     1      11.300  -0.580   0.151  1.00  0.00           H  
HETATM   41  H   UNL     1       8.985  -2.224  -0.753  1.00  0.00           H  
HETATM   42  H   UNL     1       9.049  -1.358   0.801  1.00  0.00           H  
HETATM   43  H   UNL     1       6.971  -0.947  -1.397  1.00  0.00           H  
HETATM   44  H   UNL     1       6.705  -1.786   0.151  1.00  0.00           H  
HETATM   45  H   UNL     1       7.437   1.457  -1.387  1.00  0.00           H  
HETATM   46  H   UNL     1       7.501   2.323   0.167  1.00  0.00           H  
HETATM   47  H   UNL     1       9.515   1.045   0.811  1.00  0.00           H  
HETATM   48  H   UNL     1       9.781   1.884  -0.737  1.00  0.00           H  
HETATM   49  H   UNL     1       5.093  -1.264  -0.714  1.00  0.00           H  
HETATM   50  H   UNL     1       2.678  -0.796  -0.728  1.00  0.00           H  
HETATM   51  H   UNL     1       1.189   2.269   0.198  1.00  0.00           H  
HETATM   52  H   UNL     1       0.607  -2.947   0.771  1.00  0.00           H  
HETATM   53  H   UNL     1      -4.920  -3.046   1.078  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.438  -1.367   0.795  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.087  -1.824  -1.773  1.00  0.00           H  
HETATM   56  H   UNL     1      -5.839  -4.438  -0.426  1.00  0.00           H  
HETATM   57  H   UNL     1      -6.006  -3.982  -2.233  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.117   3.652  -0.373  1.00  0.00           H  
HETATM   59  H   UNL     1      -3.677   4.051  -0.113  1.00  0.00           H  
HETATM   60  H   UNL     1      -2.179   2.097   0.210  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.291   1.121  -2.500  1.00  0.00           H  
HETATM   62  H   UNL     1      -8.908   1.519  -1.870  1.00  0.00           H  
HETATM   63  H   UNL     1      -7.634   2.761  -1.898  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.370  -0.512   0.844  1.00  0.00           H  
HETATM   65  H   UNL     1      -8.754  -0.393  -0.268  1.00  0.00           H  
HETATM   66  H   UNL     1      -7.137  -0.790  -0.898  1.00  0.00           H  
HETATM   67  H   UNL     1      -9.074   1.924   0.578  1.00  0.00           H  
HETATM   68  H   UNL     1       3.385   2.911   1.282  1.00  0.00           H  
HETATM   69  H   UNL     1       5.800   2.438   1.306  1.00  0.00           H  
CONECT    1    2   38   39   40                                       
CONECT    2    1    3    7                                            
CONECT    3    2    4   41   42                                       
CONECT    4    3    5   43   44                                       
CONECT    5    4    6    8                                            
CONECT    6    7    5   45   46                                       
CONECT    7    2    6   47   48                                       
CONECT    8    5   37   37    9                                       
CONECT    9    8   10   10   49                                       
CONECT   10    9    9   11   50                                       
CONECT   11   36   36   10   12                                       
CONECT   12   11   13   51                                            
CONECT   13   12   25   25   14                                       
CONECT   14   13   15   15                                            
CONECT   15   14   14   16   52                                       
CONECT   16   24   24   15   17                                       
CONECT   17   16   19   18   18                                       
CONECT   18   17   17                                                 
CONECT   19   23   17   20                                            
CONECT   20   19   21   53   54                                       
CONECT   21   20   22   22   55                                       
CONECT   22   21   21   56   57                                       
CONECT   23   26   24   19                                            
CONECT   24   25   23   16   16                                       
CONECT   25   13   13   24                                            
CONECT   26   31   31   27   23                                       
CONECT   27   28   28   26                                            
CONECT   28   29   32   27   27                                       
CONECT   29   30   30   28   58                                       
CONECT   30   29   29   31   59                                       
CONECT   31   30   26   26   60                                       
CONECT   32   33   28   35   34                                       
CONECT   33   32   61   62   63                                       
CONECT   34   32   64   65   66                                       
CONECT   35   32   67                                                 
CONECT   36   37   11   11   68                                       
CONECT   37    8    8   36   69                                       
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    3                                                      
CONECT   42    3                                                      
CONECT   43    4                                                      
CONECT   44    4                                                      
CONECT   45    6                                                      
CONECT   46    6                                                      
CONECT   47    7                                                      
CONECT   48    7                                                      
CONECT   49    9                                                      
CONECT   50   10                                                      
CONECT   51   12                                                      
CONECT   52   15                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   21                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
CONECT   60   31                                                      
CONECT   61   33                                                      
CONECT   62   33                                                      
CONECT   63   33                                                      
CONECT   64   34                                                      
CONECT   65   34                                                      
CONECT   66   34                                                      
CONECT   67   35                                                      
CONECT   68   36                                                      
CONECT   69   37                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
