COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.662  -1.534  -0.454  1.00  0.00           C  
HETATM    2  C   UNL     1       6.854  -2.232  -0.195  1.00  0.00           C  
HETATM    3  C   UNL     1       7.072  -1.056   1.780  1.00  0.00           C  
HETATM    4  C   UNL     1       5.235  -0.578   0.484  1.00  0.00           C  
HETATM    5  C   UNL     1       3.814  -0.677  -1.199  1.00  0.00           C  
HETATM    6  C   UNL     1       3.247   0.982   0.615  1.00  0.00           C  
HETATM    7  C   UNL     1       3.728   2.386   0.187  1.00  0.00           C  
HETATM    8  C   UNL     1       2.425   3.204   0.048  1.00  0.00           C  
HETATM    9  C   UNL     1       1.310   2.197   0.408  1.00  0.00           C  
HETATM   10  C   UNL     1       0.080   2.426  -0.473  1.00  0.00           C  
HETATM   11  C   UNL     1       8.571  -3.898  -0.798  1.00  0.00           C  
HETATM   12  N   UNL     1       7.516  -1.960   0.924  1.00  0.00           N  
HETATM   13  N   UNL     1       5.966  -0.373   1.575  1.00  0.00           N  
HETATM   14  N   UNL     1       7.327  -3.180  -1.085  1.00  0.00           N  
HETATM   15  N   UNL     1       4.750  -1.544  -1.456  1.00  0.00           N  
HETATM   16  N   UNL     1       4.069  -0.055  -0.014  1.00  0.00           N  
HETATM   17  O   UNL     1       4.571   2.954   1.192  1.00  0.00           O  
HETATM   18  O   UNL     1       2.422   4.302   0.963  1.00  0.00           O  
HETATM   19  O   UNL     1       1.885   0.899   0.142  1.00  0.00           O  
HETATM   20  O   UNL     1      -0.978   1.565  -0.047  1.00  0.00           O  
HETATM   21  O   UNL     1      -2.261   1.290  -2.203  1.00  0.00           O  
HETATM   22  O   UNL     1      -3.156   2.956  -0.531  1.00  0.00           O  
HETATM   23  O   UNL     1      -3.317   0.367  -0.105  1.00  0.00           O  
HETATM   24  O   UNL     1      -4.191  -1.595  -1.621  1.00  0.00           O  
HETATM   25  O   UNL     1      -5.562   0.491  -1.251  1.00  0.00           O  
HETATM   26  O   UNL     1      -5.344  -1.107   0.690  1.00  0.00           O  
HETATM   27  O   UNL     1      -7.895  -0.582   1.050  1.00  0.00           O  
HETATM   28  O   UNL     1      -7.140  -2.652  -0.181  1.00  0.00           O  
HETATM   29  O   UNL     1      -6.776  -2.597   2.316  1.00  0.00           O  
HETATM   30  P   UNL     1      -2.425   1.539  -0.753  1.00  0.00           P  
HETATM   31  P   UNL     1      -4.624  -0.441  -0.586  1.00  0.00           P  
HETATM   32  P   UNL     1      -6.796  -1.754   0.944  1.00  0.00           P  
HETATM   33  H   UNL     1       7.642  -0.865   2.677  1.00  0.00           H  
HETATM   34  H   UNL     1       2.962  -0.479  -1.833  1.00  0.00           H  
HETATM   35  H   UNL     1       3.278   0.884   1.700  1.00  0.00           H  
HETATM   36  H   UNL     1       4.253   2.336  -0.766  1.00  0.00           H  
HETATM   37  H   UNL     1       2.303   3.558  -0.975  1.00  0.00           H  
HETATM   38  H   UNL     1       1.044   2.286   1.462  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.240   3.465  -0.388  1.00  0.00           H  
HETATM   40  H   UNL     1       0.331   2.207  -1.511  1.00  0.00           H  
HETATM   41  H   UNL     1       9.391  -3.184  -0.713  1.00  0.00           H  
HETATM   42  H   UNL     1       8.467  -4.445   0.140  1.00  0.00           H  
HETATM   43  H   UNL     1       8.781  -4.599  -1.606  1.00  0.00           H  
HETATM   44  H   UNL     1       6.834  -3.370  -1.898  1.00  0.00           H  
HETATM   45  H   UNL     1       4.853   3.859   1.003  1.00  0.00           H  
HETATM   46  H   UNL     1       3.140   4.935   0.820  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.296   3.185   0.398  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.575  -2.243  -1.253  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.733   0.045   1.768  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.620  -3.016   2.533  1.00  0.00           H  
CONECT    1    2   15    4    4                                       
CONECT    2   14   12   12    1                                       
CONECT    3   12   13   13   33                                       
CONECT    4    1    1   13   16                                       
CONECT    5   15   15   16   34                                       
CONECT    6    7   16   19   35                                       
CONECT    7   17    8    6   36                                       
CONECT    8    7   18    9   37                                       
CONECT    9    8   19   10   38                                       
CONECT   10    9   20   39   40                                       
CONECT   11   14   41   42   43                                       
CONECT   12    2    2    3                                            
CONECT   13    3    3    4                                            
CONECT   14   11    2   44                                            
CONECT   15    1    5    5                                            
CONECT   16    4    5    6                                            
CONECT   17    7   45                                                 
CONECT   18    8   46                                                 
CONECT   19    6    9                                                 
CONECT   20   10   30                                                 
CONECT   21   30   30                                                 
CONECT   22   30   47                                                 
CONECT   23   30   31                                                 
CONECT   24   31   48                                                 
CONECT   25   31   31                                                 
CONECT   26   31   32                                                 
CONECT   27   32   49                                                 
CONECT   28   32   32                                                 
CONECT   29   32   50                                                 
CONECT   30   20   21   21   23                                       
CONECT   30   22                                                      
CONECT   31   23   25   25   26                                       
CONECT   31   24                                                      
CONECT   32   26   28   28   29                                       
CONECT   32   27                                                      
CONECT   33    3                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    8                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   14                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   22                                                      
CONECT   48   24                                                      
CONECT   49   27                                                      
CONECT   50   29                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
