COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       7.736  -2.395   0.436  1.00  0.00           N  
HETATM    2  C   UNL     1       7.535  -1.360   1.230  1.00  0.00           C  
HETATM    3  N   UNL     1       6.424  -0.654   1.203  1.00  0.00           N  
HETATM    4  C   UNL     1       5.446  -0.962   0.358  1.00  0.00           C  
HETATM    5  C   UNL     1       5.612  -2.056  -0.509  1.00  0.00           C  
HETATM    6  C   UNL     1       6.815  -2.779  -0.442  1.00  0.00           C  
HETATM    7  N   UNL     1       7.035  -3.865  -1.270  1.00  0.00           N  
HETATM    8  N   UNL     1       4.484  -2.151  -1.253  1.00  0.00           N  
HETATM    9  C   UNL     1       3.656  -1.208  -0.906  1.00  0.00           C  
HETATM   10  N   UNL     1       4.203  -0.449   0.084  1.00  0.00           N  
HETATM   11  P   UNL     1      -2.023   1.583  -0.593  1.00  0.00           P  
HETATM   12  P   UNL     1      -4.639   0.295  -0.060  1.00  0.00           P  
HETATM   13  P   UNL     1      -6.224  -2.064   0.782  1.00  0.00           P  
HETATM   14  C   UNL     1       3.580   0.705   0.738  1.00  0.00           C  
HETATM   15  O   UNL     1      -6.389  -2.760   2.224  1.00  0.00           O  
HETATM   16  O   UNL     1      -4.849  -0.028  -1.489  1.00  0.00           O  
HETATM   17  S   UNL     1      -1.775   0.859  -2.570  1.00  0.00           S  
HETATM   18  C   UNL     1       4.031   2.025   0.061  1.00  0.00           C  
HETATM   19  O   UNL     1       5.257   2.494   0.625  1.00  0.00           O  
HETATM   20  O   UNL     1      -2.513   2.978  -0.636  1.00  0.00           O  
HETATM   21  O   UNL     1      -5.560   1.551   0.348  1.00  0.00           O  
HETATM   22  O   UNL     1      -7.490  -1.392   0.411  1.00  0.00           O  
HETATM   23  C   UNL     1       2.863   2.981   0.406  1.00  0.00           C  
HETATM   24  O   UNL     1       3.191   3.783   1.542  1.00  0.00           O  
HETATM   25  O   UNL     1      -3.091   0.663   0.186  1.00  0.00           O  
HETATM   26  O   UNL     1      -5.037  -0.978   0.842  1.00  0.00           O  
HETATM   27  O   UNL     1      -5.870  -3.186  -0.318  1.00  0.00           O  
HETATM   28  C   UNL     1       1.687   2.040   0.732  1.00  0.00           C  
HETATM   29  O   UNL     1       2.151   0.693   0.534  1.00  0.00           O  
HETATM   30  C   UNL     1       0.513   2.329  -0.206  1.00  0.00           C  
HETATM   31  O   UNL     1      -0.610   1.534   0.178  1.00  0.00           O  
HETATM   32  H   UNL     1       8.310  -1.082   1.929  1.00  0.00           H  
HETATM   33  H   UNL     1       7.870  -4.357  -1.215  1.00  0.00           H  
HETATM   34  H   UNL     1       6.355  -4.136  -1.907  1.00  0.00           H  
HETATM   35  H   UNL     1       2.679  -1.051  -1.339  1.00  0.00           H  
HETATM   36  H   UNL     1       3.818   0.718   1.801  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.088  -3.427   2.262  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.333  -0.397  -2.379  1.00  0.00           H  
HETATM   39  H   UNL     1       4.124   1.897  -1.017  1.00  0.00           H  
HETATM   40  H   UNL     1       5.580   3.317   0.235  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.473   1.818   1.273  1.00  0.00           H  
HETATM   42  H   UNL     1       2.621   3.612  -0.450  1.00  0.00           H  
HETATM   43  H   UNL     1       3.962   4.353   1.412  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.051  -3.668  -0.138  1.00  0.00           H  
HETATM   45  H   UNL     1       1.377   2.179   1.767  1.00  0.00           H  
HETATM   46  H   UNL     1       0.250   3.385  -0.143  1.00  0.00           H  
HETATM   47  H   UNL     1       0.798   2.086  -1.230  1.00  0.00           H  
CONECT    1    2    2    6                                            
CONECT    2    1    1    3   32                                       
CONECT    3    2    4    4                                            
CONECT    4    3    3    5   10                                       
CONECT    5    6    6    4    8                                       
CONECT    6    1    7    5    5                                       
CONECT    7    6   33   34                                            
CONECT    8    5    9    9                                            
CONECT    9   10    8    8   35                                       
CONECT   10    4   14    9                                            
CONECT   11   20   20   31   25                                       
CONECT   11   17                                                      
CONECT   12   25   16   16   26                                       
CONECT   12   21                                                      
CONECT   13   26   22   22   15                                       
CONECT   13   27                                                      
CONECT   14   10   18   29   36                                       
CONECT   15   13   37                                                 
CONECT   16   12   12                                                 
CONECT   17   11   38                                                 
CONECT   18   19   14   23   39                                       
CONECT   19   18   40                                                 
CONECT   20   11   11                                                 
CONECT   21   12   41                                                 
CONECT   22   13   13                                                 
CONECT   23   24   18   28   42                                       
CONECT   24   23   43                                                 
CONECT   25   11   12                                                 
CONECT   26   12   13                                                 
CONECT   27   13   44                                                 
CONECT   28   23   29   30   45                                       
CONECT   29   14   28                                                 
CONECT   30   28   31   46   47                                       
CONECT   31   30   11                                                 
CONECT   32    2                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36   14                                                      
CONECT   37   15                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   19                                                      
CONECT   41   21                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   27                                                      
CONECT   45   28                                                      
CONECT   46   30                                                      
CONECT   47   30                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
