COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.232   3.694   0.371  1.00  0.00           C  
HETATM    2  N   UNL     1      -1.839  -0.477   0.170  1.00  0.00           N  
HETATM    3  C   UNL     1      -2.642  -1.599  -0.336  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.754  -2.531  -1.162  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.773  -1.060  -1.214  1.00  0.00           C  
HETATM    6  O   UNL     1      -4.534  -0.101  -0.477  1.00  0.00           O  
HETATM    7  C   UNL     1      -3.228  -2.361   0.825  1.00  0.00           C  
HETATM    8  O   UNL     1      -4.327  -2.854   0.732  1.00  0.00           O  
HETATM    9  O   UNL     1      -2.528  -2.492   1.963  1.00  0.00           O  
HETATM   10  O   UNL     1       3.980  -1.713  -1.474  1.00  0.00           O  
HETATM   11  P   UNL     1       3.987  -1.204  -0.084  1.00  0.00           P  
HETATM   12  O   UNL     1       3.537  -2.379   0.920  1.00  0.00           O  
HETATM   13  O   UNL     1       5.470  -0.709   0.298  1.00  0.00           O  
HETATM   14  O   UNL     1       2.961   0.031   0.040  1.00  0.00           O  
HETATM   15  C   UNL     1       1.584  -0.061  -0.334  1.00  0.00           C  
HETATM   16  C   UNL     1       0.909   1.265  -0.094  1.00  0.00           C  
HETATM   17  C   UNL     1       1.625   2.332   0.416  1.00  0.00           C  
HETATM   18  N   UNL     1       1.045   3.497   0.630  1.00  0.00           N  
HETATM   19  C   UNL     1      -0.436   1.429  -0.380  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.251   0.290  -0.937  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.017   2.671  -0.142  1.00  0.00           C  
HETATM   22  O   UNL     1      -2.333   2.878  -0.408  1.00  0.00           O  
HETATM   23  C   UNL     1      -0.848   5.043   0.640  1.00  0.00           C  
HETATM   24  H   UNL     1      -1.125  -0.801   0.805  1.00  0.00           H  
HETATM   25  H   UNL     1      -0.948  -2.914  -0.536  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.350  -3.363  -1.537  1.00  0.00           H  
HETATM   27  H   UNL     1      -1.331  -1.980  -2.001  1.00  0.00           H  
HETATM   28  H   UNL     1      -3.351  -0.586  -2.100  1.00  0.00           H  
HETATM   29  H   UNL     1      -4.421  -1.883  -1.517  1.00  0.00           H  
HETATM   30  H   UNL     1      -5.270   0.283  -0.974  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.945  -2.989   2.680  1.00  0.00           H  
HETATM   32  H   UNL     1       3.519  -2.115   1.850  1.00  0.00           H  
HETATM   33  H   UNL     1       6.142  -1.403   0.245  1.00  0.00           H  
HETATM   34  H   UNL     1       1.511  -0.319  -1.390  1.00  0.00           H  
HETATM   35  H   UNL     1       1.096  -0.830   0.264  1.00  0.00           H  
HETATM   36  H   UNL     1       2.675   2.210   0.642  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.609  -0.361  -1.529  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.047   0.687  -1.567  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.509   3.193  -1.306  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.232   5.069   1.660  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.093   5.818   0.516  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.665   5.215  -0.061  1.00  0.00           H  
CONECT    1   23   18   18   21                                       
CONECT    2   20    3   24                                            
CONECT    3    2    5    4    7                                       
CONECT    4    3   25   26   27                                       
CONECT    5    6    3   28   29                                       
CONECT    6    5   30                                                 
CONECT    7    3    8    8    9                                       
CONECT    8    7    7                                                 
CONECT    9    7   31                                                 
CONECT   10   11   11                                                 
CONECT   11   14   10   10   12                                       
CONECT   11   13                                                      
CONECT   12   11   32                                                 
CONECT   13   11   33                                                 
CONECT   14   15   11                                                 
CONECT   15   16   14   34   35                                       
CONECT   16   17   17   19   15                                       
CONECT   17   18   16   16   36                                       
CONECT   18    1    1   17                                            
CONECT   19   21   21   16   20                                       
CONECT   20   19    2   37   38                                       
CONECT   21    1   22   19   19                                       
CONECT   22   21   39                                                 
CONECT   23    1   40   41   42                                       
CONECT   24    2                                                      
CONECT   25    4                                                      
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    5                                                      
CONECT   30    6                                                      
CONECT   31    9                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   15                                                      
CONECT   35   15                                                      
CONECT   36   17                                                      
CONECT   37   20                                                      
CONECT   38   20                                                      
CONECT   39   22                                                      
CONECT   40   23                                                      
CONECT   41   23                                                      
CONECT   42   23                                                      
MASTER        0    0    0    0    0    0    0    0   42    0   42    0
END
