COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -6.634   2.036  -2.191  1.00  0.00           O  
HETATM    2  P   UNL     1      -6.253   1.557  -0.702  1.00  0.00           P  
HETATM    3  O   UNL     1      -5.854   2.838   0.188  1.00  0.00           O  
HETATM    4  O   UNL     1      -7.416   0.875  -0.091  1.00  0.00           O  
HETATM    5  O   UNL     1      -5.008   0.539  -0.767  1.00  0.00           O  
HETATM    6  P   UNL     1      -4.418  -0.573   0.237  1.00  0.00           P  
HETATM    7  O   UNL     1      -5.290  -1.921   0.116  1.00  0.00           O  
HETATM    8  O   UNL     1      -4.483  -0.067   1.627  1.00  0.00           O  
HETATM    9  O   UNL     1      -2.887  -0.887  -0.149  1.00  0.00           O  
HETATM   10  C   UNL     1      -2.053  -1.755   0.621  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.666  -1.831  -0.021  1.00  0.00           C  
HETATM   12  O   UNL     1       0.028  -0.574   0.131  1.00  0.00           O  
HETATM   13  C   UNL     1       0.214  -2.861   0.721  1.00  0.00           C  
HETATM   14  O   UNL     1       0.219  -4.109   0.026  1.00  0.00           O  
HETATM   15  C   UNL     1       1.623  -2.227   0.710  1.00  0.00           C  
HETATM   16  O   UNL     1       2.543  -3.063   0.006  1.00  0.00           O  
HETATM   17  C   UNL     1       1.427  -0.889  -0.038  1.00  0.00           C  
HETATM   18  N   UNL     1       2.261   0.156   0.561  1.00  0.00           N  
HETATM   19  C   UNL     1       1.889   1.018   1.551  1.00  0.00           C  
HETATM   20  N   UNL     1       2.876   1.814   1.841  1.00  0.00           N  
HETATM   21  C   UNL     1       3.942   1.516   1.058  1.00  0.00           C  
HETATM   22  C   UNL     1       3.561   0.445   0.231  1.00  0.00           C  
HETATM   23  N   UNL     1       4.437  -0.043  -0.641  1.00  0.00           N  
HETATM   24  C   UNL     1       5.654   0.471  -0.732  1.00  0.00           C  
HETATM   25  S   UNL     1       6.780  -0.210  -1.904  1.00  0.00           S  
HETATM   26  C   UNL     1       8.223   0.839  -1.600  1.00  0.00           C  
HETATM   27  N   UNL     1       6.055   1.483   0.028  1.00  0.00           N  
HETATM   28  C   UNL     1       5.246   2.024   0.932  1.00  0.00           C  
HETATM   29  N   UNL     1       5.672   3.079   1.720  1.00  0.00           N  
HETATM   30  H   UNL     1      -7.378   2.652  -2.228  1.00  0.00           H  
HETATM   31  H   UNL     1      -5.098   3.334  -0.154  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.293  -2.309  -0.769  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.963  -1.367   1.635  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.495  -2.751   0.650  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.751  -2.095  -1.076  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.136  -2.996   1.744  1.00  0.00           H  
HETATM   37  H   UNL     1       0.757  -4.793   0.449  1.00  0.00           H  
HETATM   38  H   UNL     1       1.971  -2.050   1.728  1.00  0.00           H  
HETATM   39  H   UNL     1       2.658  -3.939   0.400  1.00  0.00           H  
HETATM   40  H   UNL     1       1.665  -1.007  -1.095  1.00  0.00           H  
HETATM   41  H   UNL     1       0.918   1.036   2.024  1.00  0.00           H  
HETATM   42  H   UNL     1       9.035   0.540  -2.264  1.00  0.00           H  
HETATM   43  H   UNL     1       7.962   1.880  -1.790  1.00  0.00           H  
HETATM   44  H   UNL     1       8.541   0.727  -0.564  1.00  0.00           H  
HETATM   45  H   UNL     1       6.570   3.430   1.615  1.00  0.00           H  
HETATM   46  H   UNL     1       5.073   3.467   2.377  1.00  0.00           H  
CONECT    1    2   30                                                 
CONECT    2    4    4    5    3                                       
CONECT    2    1                                                      
CONECT    3    2   31                                                 
CONECT    4    2    2                                                 
CONECT    5    6    2                                                 
CONECT    6    8    8    9    7                                       
CONECT    6    5                                                      
CONECT    7    6   32                                                 
CONECT    8    6    6                                                 
CONECT    9   10    6                                                 
CONECT   10   11    9   33   34                                       
CONECT   11   12   10   13   35                                       
CONECT   12   17   11                                                 
CONECT   13   11   15   14   36                                       
CONECT   14   13   37                                                 
CONECT   15   17   16   13   38                                       
CONECT   16   15   39                                                 
CONECT   17   18   12   15   40                                       
CONECT   18   22   19   17                                            
CONECT   19   20   20   18   41                                       
CONECT   20   21   19   19                                            
CONECT   21   28   28   22   20                                       
CONECT   22   23   23   21   18                                       
CONECT   23   24   22   22                                            
CONECT   24   25   27   27   23                                       
CONECT   25   26   24                                                 
CONECT   26   25   42   43   44                                       
CONECT   27   24   24   28                                            
CONECT   28   27   29   21   21                                       
CONECT   29   28   45   46                                            
CONECT   30    1                                                      
CONECT   31    3                                                      
CONECT   32    7                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   15                                                      
CONECT   39   16                                                      
CONECT   40   17                                                      
CONECT   41   19                                                      
CONECT   42   26                                                      
CONECT   43   26                                                      
CONECT   44   26                                                      
CONECT   45   29                                                      
CONECT   46   29                                                      
MASTER        0    0    0    0    0    0    0    0   46    0   46    0
END
