COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.231   0.204   3.961  1.00  0.00           C  
HETATM    2  O   UNL     1       2.024   1.115   3.830  1.00  0.00           O  
HETATM    3  O   UNL     1       0.506   0.098   5.090  1.00  0.00           O  
HETATM    4  C   UNL     1       0.672   1.073   6.153  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.246   0.731   7.297  1.00  0.00           C  
HETATM    6  C   UNL     1       0.189  -0.102   8.309  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.524   1.257   7.337  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.653  -0.416   9.358  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.369   0.939   8.385  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.933   0.104   9.396  1.00  0.00           C  
HETATM   11  C   UNL     1       1.081  -1.154   0.590  1.00  0.00           C  
HETATM   12  O   UNL     1      -0.027  -1.610   0.776  1.00  0.00           O  
HETATM   13  C   UNL     1       1.865  -0.586   1.745  1.00  0.00           C  
HETATM   14  C   UNL     1       3.173  -1.363   1.904  1.00  0.00           C  
HETATM   15  N   UNL     1       1.076  -0.701   2.974  1.00  0.00           N  
HETATM   16  C   UNL     1       0.849  -1.708  -1.771  1.00  0.00           C  
HETATM   17  N   UNL     1       1.611  -1.156  -0.648  1.00  0.00           N  
HETATM   18  P   UNL     1      -0.153  -0.390  -2.532  1.00  0.00           P  
HETATM   19  O   UNL     1      -1.087   0.162  -1.526  1.00  0.00           O  
HETATM   20  O   UNL     1       0.815   0.780  -3.065  1.00  0.00           O  
HETATM   21  O   UNL     1      -0.991  -0.997  -3.765  1.00  0.00           O  
HETATM   22  C   UNL     1      -1.752   0.078  -4.317  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.220  -0.250  -4.235  1.00  0.00           C  
HETATM   24  O   UNL     1      -3.578  -1.299  -3.754  1.00  0.00           O  
HETATM   25  O   UNL     1      -4.130   0.621  -4.697  1.00  0.00           O  
HETATM   26  C   UNL     1      -1.356   0.285  -5.781  1.00  0.00           C  
HETATM   27  C   UNL     1       0.111   0.614  -5.863  1.00  0.00           C  
HETATM   28  C   UNL     1       1.041  -0.400  -5.996  1.00  0.00           C  
HETATM   29  C   UNL     1       0.528   1.931  -5.811  1.00  0.00           C  
HETATM   30  C   UNL     1       2.387  -0.098  -6.071  1.00  0.00           C  
HETATM   31  C   UNL     1       1.875   2.233  -5.882  1.00  0.00           C  
HETATM   32  C   UNL     1       2.805   1.218  -6.014  1.00  0.00           C  
HETATM   33  H   UNL     1       1.705   1.059   6.501  1.00  0.00           H  
HETATM   34  H   UNL     1       0.429   2.067   5.776  1.00  0.00           H  
HETATM   35  H   UNL     1       1.189  -0.510   8.280  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.865   1.909   6.547  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.312  -1.069  10.149  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.369   1.346   8.414  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.592  -0.141  10.215  1.00  0.00           H  
HETATM   40  H   UNL     1       2.086   0.463   1.552  1.00  0.00           H  
HETATM   41  H   UNL     1       2.952  -2.412   2.097  1.00  0.00           H  
HETATM   42  H   UNL     1       3.760  -1.277   0.989  1.00  0.00           H  
HETATM   43  H   UNL     1       3.740  -0.951   2.739  1.00  0.00           H  
HETATM   44  H   UNL     1       0.443  -1.428   3.078  1.00  0.00           H  
HETATM   45  H   UNL     1       1.537  -2.115  -2.512  1.00  0.00           H  
HETATM   46  H   UNL     1       0.193  -2.501  -1.410  1.00  0.00           H  
HETATM   47  H   UNL     1       2.497  -0.791  -0.797  1.00  0.00           H  
HETATM   48  H   UNL     1       1.406   0.378  -3.717  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.552   0.991  -3.755  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.072   0.409  -4.645  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.556  -0.627  -6.343  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.937   1.106  -6.202  1.00  0.00           H  
HETATM   53  H   UNL     1       0.715  -1.428  -6.040  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.197   2.724  -5.708  1.00  0.00           H  
HETATM   55  H   UNL     1       3.114  -0.890  -6.174  1.00  0.00           H  
HETATM   56  H   UNL     1       2.201   3.261  -5.837  1.00  0.00           H  
HETATM   57  H   UNL     1       3.857   1.454  -6.072  1.00  0.00           H  
CONECT    1    2    2    3   15                                       
CONECT    2    1    1                                                 
CONECT    3    1    4                                                 
CONECT    4    3    5   33   34                                       
CONECT    5    4    6    6    7                                       
CONECT    6    5    5    8   35                                       
CONECT    7    5    9    9   36                                       
CONECT    8    6   10   10   37                                       
CONECT    9    7    7   10   38                                       
CONECT   10    8    8    9   39                                       
CONECT   11   12   12   13   17                                       
CONECT   12   11   11                                                 
CONECT   13   11   14   15   40                                       
CONECT   14   13   41   42   43                                       
CONECT   15    1   13   44                                            
CONECT   16   17   18   45   46                                       
CONECT   17   11   16   47                                            
CONECT   18   16   19   19   20                                       
CONECT   18   21                                                      
CONECT   19   18   18                                                 
CONECT   20   18   48                                                 
CONECT   21   18   22                                                 
CONECT   22   21   23   26   49                                       
CONECT   23   22   24   24   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   50                                                 
CONECT   26   22   27   51   52                                       
CONECT   27   26   28   28   29                                       
CONECT   28   27   27   30   53                                       
CONECT   29   27   31   31   54                                       
CONECT   30   28   32   32   55                                       
CONECT   31   29   29   32   56                                       
CONECT   32   30   30   31   57                                       
CONECT   33    4                                                      
CONECT   34    4                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   20                                                      
CONECT   49   22                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
CONECT   56   31                                                      
CONECT   57   32                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
