%VERSION  VERSION_STAMP = V0001.000  DATE = 03/08/04  18:34:09                  
%FLAG TITLE                                                                     
%FORMAT(20a4)                                                                   
                                                                                
%FLAG POINTERS                                                                  
%FORMAT(10I8)                                                                   
      13       5       6       6      12       8       6       8       0       0
      45       1       6       8       8       4       6       3       5       0
       0       0       0       0       0       0       0       0      13       0
       0
%FLAG ATOM_NAME                                                                 
%FORMAT(20a4)                                                                   
C2  H1  H3  H4  O5  P8  O9  O12 O15 C18 H19 H20 H21 
%FLAG CHARGE                                                                    
%FORMAT(5E16.8)                                                                 
  7.85563353E-01  8.57176992E-01  8.57176992E-01  8.57176992E-01 -8.55318317E+00
  1.96396305E+01 -1.37485431E+01 -1.37485431E+01 -8.58616554E+00  1.10336027E+00
  7.71349959E-01  7.71349959E-01  7.71349959E-01
%FLAG MASS                                                                      
%FORMAT(5E16.8)                                                                 
  1.20100000E+01  1.00800000E+00  1.00800000E+00  1.00800000E+00  1.60000000E+01
  3.09700000E+01  1.60000000E+01  1.60000000E+01  1.60000000E+01  1.20100000E+01
  1.00800000E+00  1.00800000E+00  1.00800000E+00
%FLAG ATOM_TYPE_INDEX                                                           
%FORMAT(10I8)                                                                   
       1       2       2       2       3       4       5       5       3       1
       2       2       2
%FLAG NUMBER_EXCLUDED_ATOMS                                                     
%FORMAT(10I8)                                                                   
       8       4       3       2       5       7       3       2       4       3
       2       1       1
%FLAG NONBONDED_PARM_INDEX                                                      
%FORMAT(10I8)                                                                   
       1       2       4       7      11       2       3       5       8      12
       4       5       6       9      13       7       8       9      10      14
      11      12      13      14      15
%FLAG RESIDUE_LABEL                                                             
%FORMAT(20a4)                                                                   
DMP 
%FLAG RESIDUE_POINTER                                                           
%FORMAT(10I8)                                                                   
       1
%FLAG BOND_FORCE_CONSTANT                                                       
%FORMAT(5E16.8)                                                                 
  3.40000000E+02  3.20000000E+02  5.25000000E+02  2.30000000E+02
%FLAG BOND_EQUIL_VALUE                                                          
%FORMAT(5E16.8)                                                                 
  1.09000000E+00  1.41000000E+00  1.48000000E+00  1.61000000E+00
%FLAG ANGLE_FORCE_CONSTANT                                                      
%FORMAT(5E16.8)                                                                 
  3.50000000E+01  5.00000000E+01  1.00000000E+02  1.40000000E+02  1.00000000E+02
  4.50000000E+01
%FLAG ANGLE_EQUIL_VALUE                                                         
%FORMAT(5E16.8)                                                                 
  1.91113635E+00  1.91113635E+00  1.88897066E+00  2.09265067E+00  2.10312265E+00
  1.79070858E+00
%FLAG DIHEDRAL_FORCE_CONSTANT                                                   
%FORMAT(5E16.8)                                                                 
  2.50000000E-01  3.83333333E-01  1.20000000E+00
%FLAG DIHEDRAL_PERIODICITY                                                      
%FORMAT(5E16.8)                                                                 
  3.00000000E+00  3.00000000E+00  2.00000000E+00
%FLAG DIHEDRAL_PHASE                                                            
%FORMAT(5E16.8)                                                                 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
%FLAG SOLTY                                                                     
%FORMAT(5E16.8)                                                                 
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
%FLAG LENNARD_JONES_ACOEF                                                       
%FORMAT(5E16.8)                                                                 
  1.04308023E+06  6.78771368E+04  3.25969625E+03  6.28541240E+05  3.63097246E+04
  3.61397723E+05  2.54188684E+06  1.81087383E+05  1.58759528E+06  6.02589390E+06
  6.47841731E+05  3.69471530E+04  3.70622491E+05  1.64263766E+06  3.79876399E+05
%FLAG LENNARD_JONES_BCOEF                                                       
%FORMAT(5E16.8)                                                                 
  6.75612247E+02  1.06076943E+02  1.43076527E+01  5.85549272E+02  8.66220817E+01
  4.95732238E+02  1.22636552E+03  2.01468199E+02  1.08210555E+03  2.19561270E+03
  6.26720080E+02  9.21192136E+01  5.29252520E+02  1.16041466E+03  5.64885984E+02
%FLAG BONDS_INC_HYDROGEN                                                        
%FORMAT(10I8)                                                                   
      27      30       1      27      33       1      27      36       1       0
       3       1       0       6       1       0       9       1
%FLAG BONDS_WITHOUT_HYDROGEN                                                    
%FORMAT(10I8)                                                                   
      24      27       2      15      18       3      15      21       3      15
      24       4      12      15       4       0      12       2
%FLAG ANGLES_INC_HYDROGEN                                                       
%FORMAT(10I8)                                                                   
      33      27      36       1      30      27      33       1      30      27
      36       1      24      27      30       2      24      27      33       2
      24      27      36       2       9       0      12       2       6       0
       9       1       6       0      12       2       3       0       6       1
       3       0       9       1       3       0      12       2
%FLAG ANGLES_WITHOUT_HYDROGEN                                                   
%FORMAT(10I8)                                                                   
      21      15      24       3      18      15      21       4      18      15
      24       3      15      24      27       5      12      15      18       3
      12      15      21       3      12      15      24       6       0      12
      15       5
%FLAG DIHEDRALS_INC_HYDROGEN                                                    
%FORMAT(10I8)                                                                   
      15      24      27      30       2      15      24      27      33       2
      15      24      27      36       2       9       0      12      15       2
       6       0      12      15       2       3       0      12      15       2
%FLAG DIHEDRALS_WITHOUT_HYDROGEN                                                
%FORMAT(10I8)                                                                   
      21      15      24      27       1      18      15      24      27       1
      12      15      24      27       3      12      15     -24      27       1
       0      12      15      18       1       0      12      15      21       1
       0      12      15      24       3       0      12     -15      24       1
%FLAG EXCLUDED_ATOMS_LIST                                                       
%FORMAT(10I8)                                                                   
       2       3       4       5       6       7       8       9       3       4
       5       6       4       5       6       5       6       6       7       8
       9      10       7       8       9      10      11      12      13       8
       9      10       9      10      10      11      12      13      11      12
      13      12      13      13       0
%FLAG HBOND_ACOEF                                                               
%FORMAT(5E16.8)                                                                 

%FLAG HBOND_BCOEF                                                               
%FORMAT(5E16.8)                                                                 

%FLAG HBCUT                                                                     
%FORMAT(5E16.8)                                                                 

%FLAG AMBER_ATOM_TYPE                                                           
%FORMAT(20a4)                                                                   
CT  H1  H1  H1  OS  P   O2  O2  OS  CT  H1  H1  H1  
%FLAG TREE_CHAIN_CLASSIFICATION                                                 
%FORMAT(20a4)                                                                   
M   E   E   E   M   M   E   E   M   M   E   E   E   
%FLAG JOIN_ARRAY                                                                
%FORMAT(10I8)                                                                   
       0       0       0       0       0       0       0       0       0       0
       0       0       0
%FLAG IROTAT                                                                    
%FORMAT(10I8)                                                                   
       0       0       0       0       0       0       0       0       0       0
       0       0       0
%FLAG RADII                                                                     
%FORMAT(5E16.8)                                                                 
  1.70000000E+00  1.30000000E+00  1.30000000E+00  1.30000000E+00  1.50000000E+00
  1.85000000E+00  1.50000000E+00  1.50000000E+00  1.50000000E+00  1.70000000E+00
  1.30000000E+00  1.30000000E+00  1.30000000E+00
%FLAG SCREEN                                                                    
%FORMAT(5E16.8)                                                                 
  7.20000000E-01  8.50000000E-01  8.50000000E-01  8.50000000E-01  8.50000000E-01
  8.60000000E-01  8.50000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01
  8.50000000E-01  8.50000000E-01  8.50000000E-01
