COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -7.226  -2.803   1.463  1.00  0.00           O  
HETATM    2  C   UNL     1      -6.488  -2.072   0.827  1.00  0.00           C  
HETATM    3  N   UNL     1      -5.789  -1.102   1.449  1.00  0.00           N  
HETATM    4  C   UNL     1      -4.974  -0.295   0.745  1.00  0.00           C  
HETATM    5  O   UNL     1      -4.350   0.576   1.319  1.00  0.00           O  
HETATM    6  C   UNL     1      -6.351  -2.239  -0.572  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.117  -3.320  -1.291  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.526  -1.416  -1.254  1.00  0.00           C  
HETATM    9  N   UNL     1      -4.838  -0.440  -0.586  1.00  0.00           N  
HETATM   10  C   UNL     1      -3.943   0.453  -1.326  1.00  0.00           C  
HETATM   11  O   UNL     1      -2.639   0.449  -0.720  1.00  0.00           O  
HETATM   12  C   UNL     1      -4.473   1.898  -1.261  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.318   2.698  -0.612  1.00  0.00           C  
HETATM   14  O   UNL     1      -3.151   3.964  -1.253  1.00  0.00           O  
HETATM   15  C   UNL     1      -2.098   1.779  -0.875  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.997   2.036   0.155  1.00  0.00           C  
HETATM   17  O   UNL     1       0.119   1.186  -0.117  1.00  0.00           O  
HETATM   18  P   UNL     1       1.461   1.189   0.771  1.00  0.00           P  
HETATM   19  O   UNL     1       2.008   2.563   0.834  1.00  0.00           O  
HETATM   20  O   UNL     1       1.121   0.678   2.259  1.00  0.00           O  
HETATM   21  O   UNL     1       2.549   0.208   0.103  1.00  0.00           O  
HETATM   22  P   UNL     1       4.134  -0.001   0.295  1.00  0.00           P  
HETATM   23  O   UNL     1       4.414  -0.384   1.697  1.00  0.00           O  
HETATM   24  O   UNL     1       4.902   1.371  -0.050  1.00  0.00           O  
HETATM   25  N   UNL     1       4.668  -1.219  -0.737  1.00  0.00           N  
HETATM   26  P   UNL     1       6.324  -1.470  -0.566  1.00  0.00           P  
HETATM   27  O   UNL     1       6.795  -2.639  -1.568  1.00  0.00           O  
HETATM   28  O   UNL     1       7.112  -0.111  -0.919  1.00  0.00           O  
HETATM   29  O   UNL     1       6.622  -1.865   0.828  1.00  0.00           O  
HETATM   30  H   UNL     1      -5.875  -0.983   2.408  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.723  -3.873  -0.575  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.764  -2.868  -2.043  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.416  -4.000  -1.776  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.409  -1.528  -2.322  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.872   0.130  -2.364  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.681   2.273  -2.264  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.368   1.949  -0.641  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.486   2.825   0.458  1.00  0.00           H  
HETATM   39  H   UNL     1      -3.924   4.541  -1.193  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.720   1.924  -1.887  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.682   3.078   0.098  1.00  0.00           H  
HETATM   42  H   UNL     1      -1.378   1.826   1.155  1.00  0.00           H  
HETATM   43  H   UNL     1       0.758  -0.217   2.295  1.00  0.00           H  
HETATM   44  H   UNL     1       4.764   1.683  -0.955  1.00  0.00           H  
HETATM   45  H   UNL     1       4.155  -2.074  -0.584  1.00  0.00           H  
HETATM   46  H   UNL     1       7.740  -2.837  -1.523  1.00  0.00           H  
HETATM   47  H   UNL     1       6.963   0.208  -1.820  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1    6                                       
CONECT    3    4    2   30                                            
CONECT    4    5    5    3    9                                       
CONECT    5    4    4                                                 
CONECT    6    2    8    8    7                                       
CONECT    7    6   31   32   33                                       
CONECT    8    9    6    6   34                                       
CONECT    9    4   10    8                                            
CONECT   10    9   12   11   35                                       
CONECT   11   10   15                                                 
CONECT   12   10   13   36   37                                       
CONECT   13   12   15   14   38                                       
CONECT   14   13   39                                                 
CONECT   15   11   13   16   40                                       
CONECT   16   15   17   41   42                                       
CONECT   17   16   18                                                 
CONECT   18   17   19   19   21                                       
CONECT   18   20                                                      
CONECT   19   18   18                                                 
CONECT   20   18   43                                                 
CONECT   21   18   22                                                 
CONECT   22   23   23   21   25                                       
CONECT   22   24                                                      
CONECT   23   22   22                                                 
CONECT   24   22   44                                                 
CONECT   25   22   26   45                                            
CONECT   26   25   29   29   28                                       
CONECT   26   27                                                      
CONECT   27   26   46                                                 
CONECT   28   26   47                                                 
CONECT   29   26   26                                                 
CONECT   30    3                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    8                                                      
CONECT   35   10                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   14                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   20                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   27                                                      
CONECT   47   28                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
