NMR Restraints Grid

Result table
 (Save to zip file containing files for each block)

image mrblock_id pdb_id bmrb_id cing stage position program type
635067 6ia4 34332 cing 1-original 5 unknown unknown


# Restraints file 2: hTel_oxo21.top
%VERSION  VERSION_STAMP = V0001.000  DATE = 03/15/18  09:30:19                  
%FLAG TITLE                                                                     
%FORMAT(20a4)                                                                   
default_name                                                                    
%FLAG POINTERS                                                                  
%FORMAT(10I8)                                                                   
     780      14     274     569     650     882    1313    1810       0       0
    4350      24     569     882    1810      47     102      67      27       0
       0       0       0       0       0       0       0       0      34       0
       0
%FLAG ATOM_NAME                                                                 
%FORMAT(20a4)                                                                   
HO5'O5' C5' H5' H5''C4' H4' O4' C1' H1' N1  C6  H6  C5  C7  H71 H72 H73 C4  O4  
N3  H3  C2  O2  C3' H3' C2' H2' H2''O3' P   OP1 OP2 O5' C5' H5' H5''C4' H4' O4' 
C1' H1' N1  C6  H6  C5  C7  H71 H72 H73 C4  O4  N3  H3  C2  O2  C3' H3' C2' H2' 
H2''O3' P   OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9  C8  H8  N7  C5  C6  
O6  N1  H1  C2  N2  H21 H22 N3  C4  C3' H3' C2' H2' H2''O3' P   OP1 OP2 O5' C5' 
H5' H5''C4' H4' O4' C1' H1' N9  C8  H8  N7  C5  C6  O6  N1  H1  C2  N2  H21 H22 
N3  C4  C3' H3' C2' H2' H2''O3' P   OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' 
N9  C8  H8  N7  C5  C6  O6  N1  H1  C2  N2  H21 H22 N3  C4  C3' H3' C2' H2' H2''
O3' P   OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N1  C6  H6  C5  C7  H71 H72 
H73 C4  O4  N3  H3  C2  O2  C3' H3' C2' H2' H2''O3' P   OP1 OP2 O5' C5' H5' H5''
C4' H4' O4' C1' H1' N1  C6  H6  C5  C7  H71 H72 H73 C4  O4  N3  H3  C2  O2  C3' 
H3' C2' H2' H2''O3' P   OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9  C8  H8  
N7  C5  C6  N6  H61 H62 N1  C2  H2  N3  C4  C3' H3' C2' H2' H2''O3' P   OP1 OP2 
O5' C5' H5' H5''C4' H4' O4' C1' H1' N9  C8  H8  N7  C5  C6  O6  N1  H1  C2  N2  
H21 H22 N3  C4  C3' H3' C2' H2' H2''O3' P   OP1 OP2 O5' C5' H5' H5''C4' H4' O4' 
C1' H1' N9  C8  H8  N7  C5  C6  O6  N1  H1  C2  N2  H21 H22 N3  C4  C3' H3' C2' 
H2' H2''O3' P   OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9  C8  H8  N7  C5  
C6  O6  N1  H1  C2  N2  H21 H22 N3  C4  C3' H3' C2' H2' H2''O3' P   OP1 OP2 O5' 
C5' H5' H5''C4' H4' O4' C1' H1' N1  C6  H6  C5  C7  H71 H72 H73 C4  O4  N3  H3  
C2  O2  C3' H3' C2' H2' H2''O3' P   OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' 
N1  C6  H6  C5  C7  H71 H72 H73 C4  O4  N3  H3  C2  O2  C3' H3' C2' H2' H2''O3' 
P   OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9  C8  H8  N7  C5  C6  N6  H61 
H62 N1  C2  H2  N3  C4  C3' H3' C2' H2' H2''O3' P   OP1 OP2 O5' C5' H5' H5''C4' 
H4' O4' C1' H1' N9  C8  H8  N7  C5  C6  O6  N1  H1  C2  N2  H21 H22 N3  C4  C3' 
H3' C2' H2' H2''O3' P   OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9  C8  H8  
N7  C5  C6  O6  N1  H1  C2  N2  H21 H22 N3  C4  C3' H3' C2' H2' H2''O3' P   OP1 
OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9  C8  H8  N7  C5  C6  O6  N1  H1  C2  
N2  H21 H22 N3  C4  C3' H3' C2' H2' H2''O3' P   OP1 OP2 O5' C5' H5' H5''C4' H4' 
O4' C1' H1' N1  C6  H6  C5  C7  H71 H72 H73 C4  O4  N3  H3  C2  O2  C3' H3' C2' 
H2' H2''O3' P   OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N1  C6  H6  C5  C7  
H71 H72 H73 C4  O4  N3  H3  C2  O2  C3' H3' C2' H2' H2''O3' P   OP1 OP2 O5' C5' 
H5' H5''C4' H4' O4' C1' H1' N9  C8  H8  N7  C5  C6  N6  H61 H62 N1  C2  H2  N3  
C4  C3' H3' C2' H2' H2''O3' P   O1P O2P O5' C5' H5'1H5'2C4' H4' O4' C1' H1' N9  
C8  O8  N7  H7  C5  C6  O6  N1  H1  C2  N2  H21 H22 N3  C4  C3' H3' C2' H2'1H2'2
O3' P   OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9  C8  H8  N7  C5  C6  O6  
N1  H1  C2  N2  H21 H22 N3  C4  C3' H3' C2' H2' H2''O3' P   OP1 OP2 O5' C5' H5' 
H5''C4' H4' O4' C1' H1' N9  C8  H8  N7  C5  C6  O6  N1  H1  C2  N2  H21 H22 N3  
C4  C3' H3' C2' H2' H2''O3' P   OP1 OP2 O5' C5' H5' H5''C4' H4' O4' C1' H1' N9  
C8  H8  N7  C5  C6  N6  H61 H62 N1  C2  H2  N3  C4  C3' H3' C2' H2' H2''O3' HO3'
%FLAG CHARGE                                                                    
%FORMAT(5E16.8)                                                                 
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  1.03447997E+01 -1.07165346E+01  1.29924999E+00  1.79489655E+00 -1.55618442E+00
  1.30836114E+00  1.30836114E+00 -9.53390736E+00  2.12453796E+01 -1.41423270E+01
 -1.41423270E+01 -9.02732742E+00 -1.25733870E-01  1.37396142E+00  1.37396142E+00
  2.96841267E+00  2.14294248E+00 -6.72585093E+00  1.23911640E+00  3.28730292E+00
 -4.35512970E-01 -4.02530607E+00  4.75055361E+00  4.55557500E-02 -4.13463987E+00
  1.40311710E+00  1.40311710E+00  1.40311710E+00  9.46466262E+00 -1.01370655E+01
 -7.90847820E+00  6.23202660E+00  1.03447997E+01 -1.07165346E+01  1.29924999E+00
  1.79489655E+00 -1.55618442E+00  1.30836114E+00  1.30836114E+00 -9.53390736E+00
  2.12453796E+01 -1.41423270E+01 -1.41423270E+01 -9.02732742E+00 -1.25733870E-01
  1.37396142E+00  1.37396142E+00  2.96841267E+00  2.14294248E+00 -6.72585093E+00
  7.85381130E-01  3.34925874E+00 -4.88357640E-01  2.92832361E+00  3.42032571E+00
 -1.12522703E+01  1.32111675E+00  1.25679203E+01 -1.66242043E+01  7.59323241E+00
  7.59323241E+00 -1.38926815E+01  1.04158667E+01  1.08969354E+00 -1.35154799E+01
  6.92447400E+00  1.29924999E+00  1.79489655E+00 -1.55618442E+00  1.30836114E+00
  1.30836114E+00 -9.53390736E+00  2.12453796E+01 -1.41423270E+01 -1.41423270E+01
 -9.02732742E+00 -1.25733870E-01  1.37396142E+00  1.37396142E+00  2.96841267E+00
  2.14294248E+00 -6.72585093E+00  6.52358340E-01  3.18161358E+00  2.02267530E+00
  8.14172364E+00 -1.01279543E+01 -9.34621767E+00  7.42923171E+00 -3.84490530E-01
  7.83376677E+00 -1.00222650E+01 -7.33447575E+00  5.95140318E+00  1.31346338E+01
 -1.75389638E+01  7.96496733E+00  7.96496733E+00 -1.11484031E+01  3.84126084E+00
  1.29924999E+00  1.79489655E+00 -1.55618442E+00  1.30836114E+00  1.30836114E+00
 -9.53390736E+00  2.12453796E+01 -1.41423270E+01 -1.41423270E+01 -9.02732742E+00
 -1.25733870E-01  1.37396142E+00  1.37396142E+00  2.96841267E+00  2.14294248E+00
 -6.72585093E+00  6.52358340E-01  3.18161358E+00  1.05142671E+00  1.34116128E+00
  3.63899331E+00 -1.04322668E+01  3.62805993E+00  8.96172714E+00 -1.03848888E+01
 -9.20772819E+00  6.41424960E+00  1.35428134E+01 -1.68191829E+01  7.71714405E+00
  7.71714405E+00 -1.20923183E+01  3.30552522E+00  1.29924999E+00  1.79489655E+00
 -1.55618442E+00  1.30836114E+00  1.30836114E+00 -9.53390736E+00  2.12453796E+01
 -1.41423270E+01 -1.41423270E+01 -9.02732742E+00 -1.25733870E-01  1.37396142E+00
  1.37396142E+00  2.96841267E+00  2.14294248E+00 -6.72585093E+00  6.52358340E-01
  3.18161358E+00  1.05142671E+00  1.34116128E+00  3.63899331E+00 -1.04322668E+01
  3.62805993E+00  8.96172714E+00 -1.03848888E+01 -9.20772819E+00  6.41424960E+00
  1.35428134E+01 -1.68191829E+01  7.71714405E+00  7.71714405E+00 -1.20923183E+01
  3.30552522E+00  1.29924999E+00  1.79489655E+00 -1.55618442E+00  1.30836114E+00
  1.30836114E+00 -9.53390736E+00  2.12453796E+01 -1.41423270E+01 -1.41423270E+01
 -9.02732742E+00 -1.25733870E-01  1.37396142E+00  1.37396142E+00  2.96841267E+00
  2.14294248E+00 -6.72585093E+00  7.85381130E-01  3.34925874E+00 -4.88357640E-01
  2.92832361E+00  3.42032571E+00 -1.12522703E+01  1.32111675E+00  1.25679203E+01
 -1.66242043E+01  7.59323241E+00  7.59323241E+00 -1.38926815E+01  1.04158667E+01
  1.08969354E+00 -1.35154799E+01  6.92447400E+00  1.29924999E+00  1.79489655E+00
 -1.55618442E+00  1.30836114E+00  1.30836114E+00 -1.19337843E+01  8.01052308E+00
%FLAG ATOMIC_NUMBER                                                             
%FORMAT(10I8)                                                                   
       1       8       6       1       1       6       1       8       6       1
       7       6       1       6       6       1       1       1       6       8
       7       1       6       8       6       1       6       1       1       8
      15       8       8       8       6       1       1       6       1       8
       6       1       7       6       1       6       6       1       1       1
       6       8       7       1       6       8       6       1       6       1
       1       8      15       8       8       8       6       1       1       6
       1       8       6       1       7       6       1       7       6       6
       8       7       1       6       7       1       1       7       6       6
       1       6       1       1       8      15       8       8       8       6
       1       1       6       1       8       6       1       7       6       1
       7       6       6       8       7       1       6       7       1       1
       7       6       6       1       6       1       1       8      15       8
       8       8       6       1       1       6       1       8       6       1
       7       6       1       7       6       6       8       7       1       6
       7       1       1       7       6       6       1       6       1       1
       8      15       8       8       8       6       1       1       6       1
       8       6       1       7       6       1       6       6       1       1
       1       6       8       7       1       6       8       6       1       6
       1       1       8      15       8       8       8       6       1       1
       6       1       8       6       1       7       6       1       6       6
       1       1       1       6       8       7       1       6       8       6
       1       6       1       1       8      15       8       8       8       6
       1       1       6       1       8       6       1       7       6       1
       7       6       6       7       1       1       7       6       1       7
       6       6       1       6       1       1       8      15       8       8
       8       6       1       1       6       1       8       6       1       7
       6       1       7       6       6       8       7       1       6       7
       1       1       7       6       6       1       6       1       1       8
      15       8       8       8       6       1       1       6       1       8
       6       1       7       6       1       7       6       6       8       7
       1       6       7       1       1       7       6       6       1       6
       1       1       8      15       8       8       8       6       1       1
       6       1       8       6       1       7       6       1       7       6
       6       8       7       1       6       7       1       1       7       6
       6       1       6       1       1       8      15       8       8       8
       6       1       1       6       1       8       6       1       7       6
       1       6       6       1       1       1       6       8       7       1
       6       8       6       1       6       1       1       8      15       8
       8       8       6       1       1       6       1       8       6       1
       7       6       1       6       6       1       1       1       6       8
       7       1       6       8       6       1       6       1       1       8
      15       8       8       8       6       1       1       6       1       8
       6       1       7       6       1       7       6       6       7       1
       1       7       6       1       7       6       6       1       6       1
       1       8      15       8       8       8       6       1       1       6
       1       8       6       1       7       6       1       7       6       6
       8       7       1       6       7       1       1       7       6       6
       1       6       1       1       8      15       8       8       8       6
       1       1       6       1       8       6       1       7       6       1
       7       6       6       8       7       1       6       7       1       1
       7       6       6       1       6       1       1       8      15       8
       8       8       6       1       1       6       1       8       6       1
       7       6       1       7       6       6       8       7       1       6
       7       1       1       7       6       6       1       6       1       1
       8      15       8       8       8       6       1       1       6       1
       8       6       1       7       6       1       6       6       1       1
       1       6       8       7       1       6       8       6       1       6
       1       1       8      15       8       8       8       6       1       1
       6       1       8       6       1       7       6       1       6       6
       1       1       1       6       8       7       1       6       8       6
       1       6       1       1       8      15       8       8       8       6
       1       1       6       1       8       6       1       7       6       1
       7       6       6       7       1       1       7       6       1       7
       6       6       1       6       1       1       8      15       8       8
       8       6       1       1       6       1       8       6       1       7
       6       8       7       1       6       6       8       7       1       6
       7       1       1       7       6       6       1       6       1       1
       8      15       8       8       8       6       1       1       6       1
       8       6       1       7       6       1       7       6       6       8
       7       1       6       7       1       1       7       6       6       1
       6       1       1       8      15       8       8       8       6       1
       1       6       1       8       6       1       7       6       1       7
       6       6       8       7       1       6       7       1       1       7
       6       6       1       6       1       1       8      15       8       8
       8       6       1       1       6       1       8       6       1       7
       6       1       7       6       6       7       1       1       7       6
       1       7       6       6       1       6       1       1       8       1
%FLAG MASS                                                                      
%FORMAT(5E16.8)                                                                 
  1.00800000E+00  1.60000000E+01  1.20100000E+01  1.00800000E+00  1.00800000E+00
  1.20100000E+01  1.00800000E+00  1.60000000E+01  1.20100000E+01  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.00800000E+00  1.20100000E+01  1.20100000E+01
  1.00800000E+00  1.00800000E+00  1.00800000E+00  1.20100000E+01  1.60000000E+01
  1.40100000E+01  1.00800000E+00  1.20100000E+01  1.60000000E+01  1.20100000E+01
  1.00800000E+00  1.20100000E+01  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  1.20100000E+01  1.00800000E+00  1.60000000E+01
  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.00800000E+00
  1.20100000E+01  1.20100000E+01  1.00800000E+00  1.00800000E+00  1.00800000E+00
  1.20100000E+01  1.60000000E+01  1.40100000E+01  1.00800000E+00  1.20100000E+01
  1.60000000E+01  1.20100000E+01  1.00800000E+00  1.20100000E+01  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  1.20100000E+01
  1.00800000E+00  1.60000000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01
  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.20100000E+01
  1.60000000E+01  1.40100000E+01  1.00800000E+00  1.20100000E+01  1.40100000E+01
  1.00800000E+00  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.20100000E+01
  1.00800000E+00  1.20100000E+01  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  1.20100000E+01  1.00800000E+00  1.60000000E+01
  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.20100000E+01  1.60000000E+01  1.40100000E+01
  1.00800000E+00  1.20100000E+01  1.40100000E+01  1.00800000E+00  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.20100000E+01  1.00800000E+00  1.20100000E+01
  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
  1.20100000E+01  1.00800000E+00  1.60000000E+01  1.20100000E+01  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01
  1.20100000E+01  1.60000000E+01  1.40100000E+01  1.00800000E+00  1.20100000E+01
  1.40100000E+01  1.00800000E+00  1.00800000E+00  1.40100000E+01  1.20100000E+01
  1.20100000E+01  1.00800000E+00  1.20100000E+01  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  1.20100000E+01  1.00800000E+00
  1.60000000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01
  1.00800000E+00  1.20100000E+01  1.20100000E+01  1.00800000E+00  1.00800000E+00
  1.00800000E+00  1.20100000E+01  1.60000000E+01  1.40100000E+01  1.00800000E+00
  1.20100000E+01  1.60000000E+01  1.20100000E+01  1.00800000E+00  1.20100000E+01
  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
  1.20100000E+01  1.00800000E+00  1.60000000E+01  1.20100000E+01  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.00800000E+00  1.20100000E+01  1.20100000E+01
  1.00800000E+00  1.00800000E+00  1.00800000E+00  1.20100000E+01  1.60000000E+01
  1.40100000E+01  1.00800000E+00  1.20100000E+01  1.60000000E+01  1.20100000E+01
  1.00800000E+00  1.20100000E+01  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  1.20100000E+01  1.00800000E+00  1.60000000E+01
  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.20100000E+01  1.40100000E+01  1.00800000E+00
  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01
  1.20100000E+01  1.20100000E+01  1.00800000E+00  1.20100000E+01  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  1.20100000E+01
  1.00800000E+00  1.60000000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01
  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.20100000E+01
  1.60000000E+01  1.40100000E+01  1.00800000E+00  1.20100000E+01  1.40100000E+01
  1.00800000E+00  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.20100000E+01
  1.00800000E+00  1.20100000E+01  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  1.20100000E+01  1.00800000E+00  1.60000000E+01
  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.20100000E+01  1.60000000E+01  1.40100000E+01
  1.00800000E+00  1.20100000E+01  1.40100000E+01  1.00800000E+00  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.20100000E+01  1.00800000E+00  1.20100000E+01
  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
  1.20100000E+01  1.00800000E+00  1.60000000E+01  1.20100000E+01  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01
  1.20100000E+01  1.60000000E+01  1.40100000E+01  1.00800000E+00  1.20100000E+01
  1.40100000E+01  1.00800000E+00  1.00800000E+00  1.40100000E+01  1.20100000E+01
  1.20100000E+01  1.00800000E+00  1.20100000E+01  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  1.20100000E+01  1.00800000E+00
  1.60000000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01
  1.00800000E+00  1.20100000E+01  1.20100000E+01  1.00800000E+00  1.00800000E+00
  1.00800000E+00  1.20100000E+01  1.60000000E+01  1.40100000E+01  1.00800000E+00
  1.20100000E+01  1.60000000E+01  1.20100000E+01  1.00800000E+00  1.20100000E+01
  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
  1.20100000E+01  1.00800000E+00  1.60000000E+01  1.20100000E+01  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.00800000E+00  1.20100000E+01  1.20100000E+01
  1.00800000E+00  1.00800000E+00  1.00800000E+00  1.20100000E+01  1.60000000E+01
  1.40100000E+01  1.00800000E+00  1.20100000E+01  1.60000000E+01  1.20100000E+01
  1.00800000E+00  1.20100000E+01  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  1.20100000E+01  1.00800000E+00  1.60000000E+01
  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.20100000E+01  1.40100000E+01  1.00800000E+00
  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01
  1.20100000E+01  1.20100000E+01  1.00800000E+00  1.20100000E+01  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  1.20100000E+01
  1.00800000E+00  1.60000000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01
  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.20100000E+01
  1.60000000E+01  1.40100000E+01  1.00800000E+00  1.20100000E+01  1.40100000E+01
  1.00800000E+00  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.20100000E+01
  1.00800000E+00  1.20100000E+01  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  1.20100000E+01  1.00800000E+00  1.60000000E+01
  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.20100000E+01  1.60000000E+01  1.40100000E+01
  1.00800000E+00  1.20100000E+01  1.40100000E+01  1.00800000E+00  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.20100000E+01  1.00800000E+00  1.20100000E+01
  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
  1.20100000E+01  1.00800000E+00  1.60000000E+01  1.20100000E+01  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01
  1.20100000E+01  1.60000000E+01  1.40100000E+01  1.00800000E+00  1.20100000E+01
  1.40100000E+01  1.00800000E+00  1.00800000E+00  1.40100000E+01  1.20100000E+01
  1.20100000E+01  1.00800000E+00  1.20100000E+01  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  1.20100000E+01  1.00800000E+00
  1.60000000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01
  1.00800000E+00  1.20100000E+01  1.20100000E+01  1.00800000E+00  1.00800000E+00
  1.00800000E+00  1.20100000E+01  1.60000000E+01  1.40100000E+01  1.00800000E+00
  1.20100000E+01  1.60000000E+01  1.20100000E+01  1.00800000E+00  1.20100000E+01
  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
  1.20100000E+01  1.00800000E+00  1.60000000E+01  1.20100000E+01  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.00800000E+00  1.20100000E+01  1.20100000E+01
  1.00800000E+00  1.00800000E+00  1.00800000E+00  1.20100000E+01  1.60000000E+01
  1.40100000E+01  1.00800000E+00  1.20100000E+01  1.60000000E+01  1.20100000E+01
  1.00800000E+00  1.20100000E+01  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  1.20100000E+01  1.00800000E+00  1.60000000E+01
  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.00800000E+00
  1.40100000E+01  1.20100000E+01  1.20100000E+01  1.40100000E+01  1.00800000E+00
  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01
  1.20100000E+01  1.20100000E+01  1.00800000E+00  1.20100000E+01  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  1.20100000E+01
  1.00800000E+00  1.60000000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01
  1.20100000E+01  1.60000000E+01  1.40100000E+01  1.00800000E+00  1.20100000E+01
  1.20100000E+01  1.60000000E+01  1.40100000E+01  1.00800000E+00  1.20100000E+01
  1.40100000E+01  1.00800000E+00  1.00800000E+00  1.40100000E+01  1.20100000E+01
  1.20100000E+01  1.00800000E+00  1.20100000E+01  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  1.20100000E+01  1.00800000E+00
  1.60000000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01
  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.20100000E+01  1.60000000E+01
  1.40100000E+01  1.00800000E+00  1.20100000E+01  1.40100000E+01  1.00800000E+00
  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.20100000E+01  1.00800000E+00
  1.20100000E+01  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  1.20100000E+01  1.00800000E+00  1.60000000E+01  1.20100000E+01
  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01
  1.20100000E+01  1.20100000E+01  1.60000000E+01  1.40100000E+01  1.00800000E+00
  1.20100000E+01  1.40100000E+01  1.00800000E+00  1.00800000E+00  1.40100000E+01
  1.20100000E+01  1.20100000E+01  1.00800000E+00  1.20100000E+01  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  1.20100000E+01
  1.00800000E+00  1.60000000E+01  1.20100000E+01  1.00800000E+00  1.40100000E+01
  1.20100000E+01  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.20100000E+01
  1.40100000E+01  1.00800000E+00  1.00800000E+00  1.40100000E+01  1.20100000E+01
  1.00800000E+00  1.40100000E+01  1.20100000E+01  1.20100000E+01  1.00800000E+00
  1.20100000E+01  1.00800000E+00  1.00800000E+00  1.60000000E+01  1.00800000E+00
%FLAG ATOM_TYPE_INDEX                                                           
%FORMAT(10I8)                                                                   
       1       2       3       4       4       3       4       5       3       6
       7       8       9       8       3      10      10      10       8      11
       7      12       8      11       3       4       3      10      10       5
      13      11      11       5       3       4       4       3       4       5
       3       6       7       8       9       8       3      10      10      10
       8      11       7      12       8      11       3       4       3      10
      10       5      13      11      11       5       3       4       4       3
       4       5       3       6       7       8      14       7       8       8
      11       7      12       8       7      12      12       7       8       3
       4       3      10      10       5      13      11      11       5       3
       4       4       3       4       5       3       6       7       8      14
       7       8       8      11       7      12       8       7      12      12
       7       8       3       4       3      10      10       5      13      11
      11       5       3       4       4       3       4       5       3       6
       7       8      14       7       8       8      11       7      12       8
       7      12      12       7       8       3       4       3      10      10
       5      13      11      11       5       3       4       4       3       4
       5       3       6       7       8       9       8       3      10      10
      10       8      11       7      12       8      11       3       4       3
      10      10       5      13      11      11       5       3       4       4
       3       4       5       3       6       7       8       9       8       3
      10      10      10       8      11       7      12       8      11       3
       4       3      10      10       5      13      11      11       5       3
       4       4       3       4       5       3       6       7       8      14
       7       8       8       7      12      12       7       8      14       7
       8       3       4       3      10      10       5      13      11      11
       5       3       4       4       3       4       5       3       6       7
       8      14       7       8       8      11       7      12       8       7
      12      12       7       8       3       4       3      10      10       5
      13      11      11       5       3       4       4       3       4       5
       3       6       7       8      14       7       8       8      11       7
      12       8       7      12      12       7       8       3       4       3
      10      10       5      13      11      11       5       3       4       4
       3       4       5       3       6       7       8      14       7       8
       8      11       7      12       8       7      12      12       7       8
       3       4       3      10      10       5      13      11      11       5
       3       4       4       3       4       5       3       6       7       8
       9       8       3      10      10      10       8      11       7      12
       8      11       3       4       3      10      10       5      13      11
      11       5       3       4       4       3       4       5       3       6
       7       8       9       8       3      10      10      10       8      11
       7      12       8      11       3       4       3      10      10       5
      13      11      11       5       3       4       4       3       4       5
       3       6       7       8      14       7       8       8       7      12
      12       7       8      14       7       8       3       4       3      10
      10       5      13      11      11       5       3       4       4       3
       4       5       3       6       7       8      14       7       8       8
      11       7      12       8       7      12      12       7       8       3
       4       3      10      10       5      13      11      11       5       3
       4       4       3       4       5       3       6       7       8      14
       7       8       8      11       7      12       8       7      12      12
       7       8       3       4       3      10      10       5      13      11
      11       5       3       4       4       3       4       5       3       6
       7       8      14       7       8       8      11       7      12       8
       7      12      12       7       8       3       4       3      10      10
       5      13      11      11       5       3       4       4       3       4
       5       3       6       7       8       9       8       3      10      10
      10       8      11       7      12       8      11       3       4       3
      10      10       5      13      11      11       5       3       4       4
       3       4       5       3       6       7       8       9       8       3
      10      10      10       8      11       7      12       8      11       3
       4       3      10      10       5      13      11      11       5       3
       4       4       3       4       5       3       6       7       8      14
       7       8       8       7      12      12       7       8      14       7
       8       3       4       3      10      10       5      13      11      11
       5       3       4       4       3       4       5       3       6       7
       8      11       7      12       8       8      11       7      12       8
       7      12      12       7       8       3       4       3      10      10
       5      13      11      11       5       3       4       4       3       4
       5       3       6       7       8      14       7       8       8      11
       7      12       8       7      12      12       7       8       3       4
       3      10      10       5      13      11      11       5       3       4
       4       3       4       5       3       6       7       8      14       7
       8       8      11       7      12       8       7      12      12       7
       8       3       4       3      10      10       5      13      11      11
       5       3       4       4       3       4       5       3       6       7
       8      14       7       8       8       7      12      12       7       8
      14       7       8       3       4       3      10      10       2       1
%FLAG NUMBER_EXCLUDED_ATOMS                                                     
%FORMAT(10I8)                                                                   
       5       7      10       5       4      12       6      11      14       7
      13      12       4       9       6       3       2       1       5       3
       3       2       2       1       9       5       4       2       1       5
       7       3       2       7      10       5       4      12       6      11
      14       7      13      12       4       9       6       3       2       1
       5       3       3       2       2       1       9       5       4       2
       1       5       7       3       2       7      10       5       4      12
       6      11      14       7      12       7       3       6       7       7
       4       7       3       5       4       2       1       1       1       9
       5       4       2       1       5       7       3       2       7      10
       5       4      12       6      11      14       7      12       7       3
       6       7       7       4       7       3       5       4       2       1
       1       1       9       5       4       2       1       5       7       3
       2       7      10       5       4      12       6      11      14       7
      12       7       3       6       7       7       4       7       3       5
       4       2       1       1       1       9       5       4       2       1
       5       7       3       2       7      10       5       4      12       6
      11      14       7      13      12       4       9       6       3       2
       1       5       3       3       2       2       1       9       5       4
       2       1       5       7       3       2       7      10       5       4
      12       6      11      14       7      13      12       4       9       6
       3       2       1       5       3       3       2       2       1       9
       5       4       2       1       5       7       3       2       7      10
       5       4      12       6      11      14       7      12       7       3
       6       8       8       5       2       1       4       3       2       1
       1       9       5       4       2       1       5       7       3       2
       7      10       5       4      12       6      11      14       7      12
       7       3       6       7       7       4       7       3       5       4
       2       1       1       1       9       5       4       2       1       5
       7       3       2       7      10       5       4      12       6      11
      14       7      12       7       3       6       7       7       4       7
       3       5       4       2       1       1       1       9       5       4
       2       1       5       7       3       2       7      10       5       4
      12       6      11      14       7      12       7       3       6       7
       7       4       7       3       5       4       2       1       1       1
       9       5       4       2       1       5       7       3       2       7
      10       5       4      12       6      11      14       7      13      12
       4       9       6       3       2       1       5       3       3       2
       2       1       9       5       4       2       1       5       7       3
       2       7      10       5       4      12       6      11      14       7
      13      12       4       9       6       3       2       1       5       3
       3       2       2       1       9       5       4       2       1       5
       7       3       2       7      10       5       4      12       6      11
      14       7      12       7       3       6       8       8       5       2
       1       4       3       2       1       1       9       5       4       2
       1       5       7       3       2       7      10       5       4      12
       6      11      14       7      12       7       3       6       7       7
       4       7       3       5       4       2       1       1       1       9
       5       4       2       1       5       7       3       2       7      10
       5       4      12       6      11      14       7      12       7       3
       6       7       7       4       7       3       5       4       2       1
       1       1       9       5       4       2       1       5       7       3
       2       7      10       5       4      12       6      11      14       7
      12       7       3       6       7       7       4       7       3       5
       4       2       1       1       1       9       5       4       2       1
       5       7       3       2       7      10       5       4      12       6
      11      14       7      13      12       4       9       6       3       2
       1       5       3       3       2       2       1       9       5       4
       2       1       5       7       3       2       7      10       5       4
      12       6      11      14       7      13      12       4       9       6
       3       2       1       5       3       3       2       2       1       9
       5       4       2       1       5       7       3       2       7      10
       5       4      12       6      11      14       7      12       7       3
       6       8       8       5       2       1       4       3       2       1
       1       9       5       4       2       1       5       7       3       2
       7      10       5       4      12       6      11      14       7      13
       8       4       7       3       7       7       4       7       3       5
       4       2       1       1       1       9       5       4       2       1
       5       7       3       2       7      10       5       4      12       6
      11      14       7      12       7       3       6       7       7       4
       7       3       5       4       2       1       1       1       9       5
       4       2       1       5       7       3       2       7      10       5
       4      12       6      11      14       7      12       7       3       6
       7       7       4       7       3       5       4       2       1       1
       1       9       5       4       2       1       5       7       3       2
       7      10       5       4      12       6      11      14       7      12
       7       3       6       8       8       5       2       1       4       3
       2       1       1       6       5       4       2       1       1       1
%FLAG NONBONDED_PARM_INDEX                                                      
%FORMAT(10I8)                                                                   
       1       2       4       7      11      16      22      29      37      46
      56      67      79      92       2       3       5       8      12      17
      23      30      38      47      57      68      80      93       4       5
       6       9      13      18      24      31      39      48      58      69
      81      94       7       8       9      10      14      19      25      32
      40      49      59      70      82      95      11      12      13      14
      15      20      26      33      41      50      60      71      83      96
      16      17      18      19      20      21      27      34      42      51
      61      72      84      97      22      23      24      25      26      27
      28      35      43      52      62      73      85      98      29      30
      31      32      33      34      35      36      44      53      63      74
      86      99      37      38      39      40      41      42      43      44
      45      54      64      75      87     100      46      47      48      49
      50      51      52      53      54      55      65      76      88     101
      56      57      58      59      60      61      62      63      64      65
      66      77      89     102      67      68      69      70      71      72
      73      74      75      76      77      78      90     103      79      80
      81      82      83      84      85      86      87      88      89      90
      91     104      92      93      94      95      96      97      98      99
     100     101     102     103     104     105
%FLAG RESIDUE_LABEL                                                             
%FORMAT(20a4)                                                                   
DT5 DT  DG  DG  DG  DT  DT  DA  DG  DG  DG  DT  DT  DA  DG  DG  DG  DT  DT  DA  
8GO DG  DG  DA3 
%FLAG RESIDUE_POINTER                                                           
%FORMAT(10I8)                                                                   
       1      31      63      96     129     162     194     226     258     291
     324     357     389     421     453     486     519     552     584     616
     648     682     715     748
%FLAG BOND_FORCE_CONSTANT                                                       
%FORMAT(5E16.8)                                                                 
  2.30000000E+02  3.40000000E+02  3.40000000E+02  3.10000000E+02  3.20000000E+02
  5.70000000E+02  4.34000000E+02  4.18000000E+02  3.17000000E+02  4.10000000E+02
  3.67000000E+02  5.49000000E+02  4.48000000E+02  4.24000000E+02  3.40000000E+02
  3.37000000E+02  3.10000000E+02  3.20000000E+02  3.40000000E+02  3.40000000E+02
  3.10000000E+02  3.20000000E+02  5.53000000E+02  3.20000000E+02  5.25000000E+02
  4.61000000E+02  4.34000000E+02  4.81000000E+02  4.83000000E+02  4.27000000E+02
  4.47000000E+02  5.20000000E+02  4.14000000E+02  3.67000000E+02  5.29000000E+02
  4.40000000E+02  4.36000000E+02  3.67000000E+02  5.02000000E+02  4.69000000E+02
  3.67000000E+02  5.29000000E+02  4.40000000E+02  4.14000000E+02  5.70000000E+02
  5.29000000E+02  3.20000000E+02
%FLAG BOND_EQUIL_VALUE                                                          
%FORMAT(5E16.8)                                                                 
  1.61000000E+00  1.09000000E+00  1.09000000E+00  1.52600000E+00  1.41000000E+00
  1.22900000E+00  1.01000000E+00  1.38800000E+00  1.51000000E+00  1.44400000E+00
  1.08000000E+00  1.35000000E+00  1.36500000E+00  1.38300000E+00  1.09000000E+00
  1.47500000E+00  1.52600000E+00  1.41000000E+00  1.09000000E+00  1.09000000E+00
  1.52600000E+00  1.41000000E+00  9.60000000E-01  1.41000000E+00  1.48000000E+00
  1.35400000E+00  1.01000000E+00  1.34000000E+00  1.33900000E+00  1.38100000E+00
  1.41900000E+00  1.37000000E+00  1.39100000E+00  1.08000000E+00  1.30400000E+00
  1.37100000E+00  1.37400000E+00  1.08000000E+00  1.32400000E+00  1.40400000E+00
  1.08000000E+00  1.30400000E+00  1.37100000E+00  1.39100000E+00  1.22900000E+00
  1.30400000E+00  1.41000000E+00
%FLAG ANGLE_FORCE_CONSTANT                                                      
%FORMAT(5E16.8)                                                                 
  1.00000000E+02  4.50000000E+01  3.50000000E+01  5.00000000E+01  5.00000000E+01
  5.00000000E+01  5.00000000E+01  1.00000000E+02  5.00000000E+01  8.00000000E+01
  7.00000000E+01  7.00000000E+01  5.00000000E+01  8.00000000E+01  7.00000000E+01
  5.00000000E+01  7.00000000E+01  7.00000000E+01  6.30000000E+01  5.00000000E+01
  5.00000000E+01  7.00000000E+01  7.00000000E+01  8.00000000E+01  5.00000000E+01
  5.00000000E+01  7.00000000E+01  7.00000000E+01  4.00000000E+01  5.00000000E+01
  5.00000000E+01  5.00000000E+01  5.00000000E+01  5.00000000E+01  5.00000000E+01
  5.00000000E+01  6.00000000E+01  4.00000000E+01  5.00000000E+01  3.50000000E+01
  5.00000000E+01  5.00000000E+01  4.00000000E+01  5.00000000E+01  5.00000000E+01
  5.50000000E+01  5.00000000E+01  5.00000000E+01  1.40000000E+02  1.00000000E+02
  3.50000000E+01  7.00000000E+01  5.00000000E+01  7.00000000E+01  5.00000000E+01
  7.00000000E+01  7.00000000E+01  6.30000000E+01  7.00000000E+01  8.00000000E+01
  7.00000000E+01  7.00000000E+01  7.00000000E+01  7.00000000E+01  5.00000000E+01
  7.00000000E+01  7.00000000E+01  5.00000000E+01  7.00000000E+01  7.00000000E+01
  7.00000000E+01  7.00000000E+01  7.00000000E+01  5.00000000E+01  7.00000000E+01
  7.00000000E+01  6.30000000E+01  7.00000000E+01  7.00000000E+01  7.00000000E+01
  7.00000000E+01  5.00000000E+01  7.00000000E+01  7.00000000E+01  5.00000000E+01
  7.00000000E+01  7.00000000E+01  5.00000000E+01  1.00000000E+02  3.00000000E+01
  7.00000000E+01  7.00000000E+01  8.00000000E+01  3.00000000E+01  7.00000000E+01
  8.00000000E+01  7.00000000E+01  4.00000000E+01  3.50000000E+01  5.00000000E+01
  5.00000000E+01  5.50000000E+01
%FLAG ANGLE_EQUIL_VALUE                                                         
%FORMAT(5E16.8)                                                                 
  1.88897066E+00  1.79070858E+00  1.91113635E+00  1.91113635E+00  1.91113635E+00
  1.91113635E+00  1.91113635E+00  2.10312265E+00  2.03854544E+00  2.10486798E+00
  2.20609712E+00  2.08916001E+00  1.91113635E+00  2.18689849E+00  1.99142153E+00
  2.08916001E+00  2.12232128E+00  2.08916001E+00  2.10661331E+00  1.91113635E+00
  2.07868803E+00  2.11533996E+00  2.01411082E+00  2.11010397E+00  1.91113635E+00
  1.91113635E+00  2.11533996E+00  2.05250808E+00  1.91113635E+00  1.91113635E+00
  1.91113635E+00  1.91113635E+00  1.91113635E+00  1.91113635E+00  1.91113635E+00
  1.91113635E+00  1.91113635E+00  1.91113635E+00  1.91113635E+00  1.91113635E+00
  1.91113635E+00  1.91113635E+00  1.91113635E+00  1.91113635E+00  1.91113635E+00
  1.89368305E+00  1.91113635E+00  1.91113635E+00  2.09265067E+00  2.10312265E+00
  2.09439600E+00  2.08217869E+00  2.09439600E+00  1.95826026E+00  2.05948940E+00
  2.02458280E+00  2.15199189E+00  2.08043336E+00  2.18515316E+00  2.24798504E+00
  1.94255229E+00  2.22878641E+00  2.26892900E+00  1.92684432E+00  2.14762857E+00
  1.83957782E+00  1.81165254E+00  2.14762857E+00  1.98793087E+00  1.85354046E+00
  2.20260646E+00  2.24798504E+00  2.19562514E+00  2.01498349E+00  1.93731630E+00
  2.25322103E+00  2.04727209E+00  2.06996138E+00  2.15548255E+00  2.04727209E+00
  2.31081692E+00  2.14762857E+00  1.83957782E+00  1.81165254E+00  2.14762857E+00
  1.98793087E+00  2.24798504E+00  1.91113635E+00  2.10312265E+00  2.09439600E+00
  2.26892900E+00  1.94255229E+00  2.10486798E+00  2.09439600E+00  1.81165254E+00
  2.11010397E+00  2.01411082E+00  1.91113635E+00  1.91113635E+00  1.91113635E+00
  1.91113635E+00  1.89368305E+00
%FLAG DIHEDRAL_FORCE_CONSTANT                                                   
%FORMAT(5E16.8)                                                                 
  1.85181000E-01  1.25653100E+00  3.54858000E-01  2.50000000E-01  0.00000000E+00
  1.77488000E+00  6.46810000E-01  1.52590000E-01  1.55555556E-01  3.83333333E-01
  2.94070000E-01  9.28870000E-01  9.74250000E-01  0.00000000E+00  1.35000000E+00
  2.17500000E+00  1.85000000E+00  6.65000000E+00  1.45000000E+00  1.15000000E+00
  3.80000000E-01  3.00000000E-01  1.00000000E-01  3.83000000E-01  1.17500000E+00
  1.44000000E-01  5.63230000E-01  2.17812000E+00  6.77570000E-01  1.37710000E-01
  6.50000000E-01  2.00000000E-01  2.50000000E-01  1.80000000E-01  1.60000000E-01
  1.17804000E+00  9.21020000E-02  9.62830000E-01  1.66666667E-01  2.50000000E-01
  5.27950000E-01  9.12740000E-02  5.35535000E-01  7.97600000E-02  2.40000000E+00
  4.80000000E+00  1.50000000E+00  3.00000000E+00  5.45000000E+00  4.15000000E+00
  1.70000000E+00  1.00000000E+01  1.65000000E+00  2.55000000E+00  1.18653000E+00
  1.82910000E+00  6.65630000E-01  6.80000000E+00  3.50000000E+00  1.54499000E+00
  1.82864000E+00  5.73840000E-01  1.20000000E+00  1.40000000E+00  1.05000000E+01
  1.00000000E+00  1.10000000E+00
%FLAG DIHEDRAL_PERIODICITY                                                      
%FORMAT(5E16.8)                                                                 
  1.00000000E+00  2.00000000E+00  3.00000000E+00  1.00000000E+00  3.00000000E+00
  1.00000000E+00  2.00000000E+00  3.00000000E+00  3.00000000E+00  3.00000000E+00
  3.00000000E+00  1.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  1.00000000E+00
  3.00000000E+00  3.00000000E+00  2.00000000E+00  3.00000000E+00  2.00000000E+00
  3.00000000E+00  1.00000000E+00  2.00000000E+00  3.00000000E+00  4.00000000E+00
  2.00000000E+00  1.00000000E+00  2.00000000E+00  3.00000000E+00  3.00000000E+00
  1.00000000E+00  2.00000000E+00  3.00000000E+00  3.00000000E+00  3.00000000E+00
  1.00000000E+00  2.00000000E+00  3.00000000E+00  4.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  1.00000000E+00
  2.00000000E+00  3.00000000E+00  2.00000000E+00  2.00000000E+00  1.00000000E+00
  2.00000000E+00  3.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00
%FLAG DIHEDRAL_PHASE                                                            
%FORMAT(5E16.8)                                                                 
  5.54929070E-01  6.14285649E+00  6.23514744E+00  0.00000000E+00  0.00000000E+00
  3.59396957E+00  2.44056824E+00  2.83610365E+00  0.00000000E+00  0.00000000E+00
  6.25323814E+00  3.06008709E-02  6.12404881E+00  0.00000000E+00  3.14159400E+00
  3.14159400E+00  3.14159400E+00  3.14159400E+00  3.14159400E+00  0.00000000E+00
  3.14159400E+00  0.00000000E+00  3.14159400E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  1.65293572E+00  6.24569831E+00  3.11516447E+00  1.48989048E+00
  0.00000000E+00  3.14159400E+00  3.14159400E+00  0.00000000E+00  0.00000000E+00
  3.33317067E+00  5.15976777E+00  6.07541257E+00  0.00000000E+00  0.00000000E+00
  4.11516700E-01  3.90339511E+00  3.16964180E+00  3.75561907E+00  3.14159400E+00
  3.14159400E+00  3.14159400E+00  3.14159400E+00  3.14159400E+00  3.14159400E+00
  3.14159400E+00  3.14159400E+00  3.14159400E+00  3.14159400E+00  7.66639693E-01
  6.12408721E+00  3.06161425E+00  3.14159400E+00  3.14159400E+00  7.08469590E-01
  6.22250811E+00  3.12423320E+00  0.00000000E+00  3.14159400E+00  3.14159400E+00
  3.14159400E+00  3.14159400E+00
%FLAG SCEE_SCALE_FACTOR                                                         
%FORMAT(5E16.8)                                                                 
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00
  1.20000000E+00  1.20000000E+00  1.20000000E+00  1.20000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00
%FLAG SCNB_SCALE_FACTOR                                                         
%FORMAT(5E16.8)                                                                 
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00
  2.00000000E+00  2.00000000E+00  2.00000000E+00  2.00000000E+00  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
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00
%FLAG LENNARD_JONES_ACOEF                                                       
%FORMAT(5E16.8)                                                                 
  0.00000000E+00  0.00000000E+00  5.81803229E+05  0.00000000E+00  7.91544157E+05
  1.04308023E+06  0.00000000E+00  4.66922514E+04  6.78771368E+04  3.25969625E+03
  0.00000000E+00  4.58874091E+05  6.28541240E+05  3.63097246E+04  3.61397723E+05
  0.00000000E+00  3.15360051E+04  4.68930885E+04  2.09814978E+03  2.44050579E+04
  1.32801250E+03  0.00000000E+00  7.44975864E+05  9.95480466E+05  6.20665997E+04
  5.89818288E+05  4.24594555E+04  9.44293233E+05  0.00000000E+00  7.01803794E+05
  9.24822270E+05  6.01816484E+04  5.57281136E+05  4.15766412E+04  8.82619071E+05
  8.19971662E+05  0.00000000E+00  4.96707306E+04  7.18621074E+04  3.50301067E+03
  3.86654993E+04  2.26273716E+03  6.58473870E+04  6.37148278E+04  3.76169105E+03
  0.00000000E+00  6.82786631E+04  9.71708117E+04  4.98586848E+03  5.33379252E+04
  3.25969625E+03  8.96776989E+04  8.61541883E+04  5.34045360E+03  7.51607703E+03
  0.00000000E+00  4.71003287E+05  6.47841731E+05  3.69471530E+04  3.70622491E+05
  2.47595516E+04  6.06829342E+05  5.74393458E+05  3.93690817E+04  5.44261042E+04
  3.79876399E+05  0.00000000E+00  1.40467023E+03  2.56678134E+03  5.94667300E+01
  1.03954408E+03  3.20009193E+01  2.12601181E+03  2.27577561E+03  6.63368273E+01
  1.07193646E+02  1.02595236E+03  1.39982777E-01  0.00000000E+00  1.98683736E+06
  2.54188684E+06  1.81087383E+05  1.58759528E+06  1.27716552E+05  2.45746558E+06
  2.25370349E+06  1.90880272E+05  2.54238516E+05  1.64263766E+06  8.41065839E+03
  6.02589390E+06  0.00000000E+00  4.09427581E+04  5.98885646E+04  2.82099197E+03
  3.17965283E+04  1.80748014E+03  5.46147253E+04  5.30987710E+04  3.03448006E+03
  4.33325458E+03  3.23283631E+04  4.90239937E+01  1.60682053E+05  2.43828624E+03
%FLAG LENNARD_JONES_BCOEF                                                       
%FORMAT(5E16.8)                                                                 
  0.00000000E+00  0.00000000E+00  6.99746810E+02  0.00000000E+00  6.93079947E+02
  6.75612247E+02  0.00000000E+00  1.03606917E+02  1.06076943E+02  1.43076527E+01
  0.00000000E+00  5.89183300E+02  5.85549272E+02  8.66220817E+01  4.95732238E+02
  0.00000000E+00  8.51470647E+01  8.81685417E+01  1.14788417E+01  7.10161395E+01
  9.13231543E+00  0.00000000E+00  7.50714425E+02  7.36907417E+02  1.13252061E+02
  6.33305958E+02  9.36708259E+01  8.01323529E+02  0.00000000E+00  6.14502845E+02
  5.99015525E+02  9.40505980E+01  5.19163331E+02  7.81725398E+01  6.53361429E+02
  5.31102864E+02  0.00000000E+00  1.05648788E+02  1.07908863E+02  1.46638650E+01
  8.83744760E+01  1.17854122E+01  1.15327881E+02  9.56748258E+01  1.50233639E+01
  0.00000000E+00  1.25287818E+02  1.26919150E+02  1.76949863E+01  1.04986921E+02
  1.43076527E+01  1.36131731E+02  1.12529845E+02  1.81057616E+01  2.17257828E+01
  0.00000000E+00  6.29300710E+02  6.26720080E+02  9.21192136E+01  5.29252520E+02
  7.54103785E+01  6.77220874E+02  5.55666448E+02  9.40124296E+01  1.11805549E+02
  5.64885984E+02  0.00000000E+00  1.79702257E+01  2.06278363E+01  1.93248820E+00
  1.46567808E+01  1.41762397E+00  2.09604198E+01  1.82891803E+01  2.01792524E+00
  2.59456373E+00  1.53505284E+01  9.37598976E-02  0.00000000E+00  1.27682121E+03
  1.22636552E+03  2.01468199E+02  1.08210555E+03  1.69194406E+02  1.34630496E+03
  1.08732781E+03  2.04498832E+02  2.38716853E+02  1.16041466E+03  4.34187588E+01
  2.19561270E+03  0.00000000E+00  9.59185913E+01  9.85097219E+01  1.31591746E+01
  8.01410250E+01  1.05333009E+01  1.05031585E+02  8.73413012E+01  1.34932874E+01
  1.63092814E+01  8.51921330E+01  1.73473071E+00  1.87626421E+02  1.20953369E+01
%FLAG BONDS_INC_HYDROGEN                                                        
%FORMAT(10I8)                                                                   
      78      81       2      78      84       2      72      75       3      60
      63       7      42      45       2      42      48       2      42      51
       2      33      36      11      24      27      15      15      18      19
       6       9      20       6      12      20       0       3      23     174
     177       2     174     180       2     168     171       3     156     159
       7     138     141       2     138     144       2     138     147       2
     129     132      11     120     123      15     111     114      19     102
     105      20     102     108      20     273     276       2     273     279
       2     267     270       3     252     255      27     252     258      27
     243     246       7     225     228      34     216     219      15     207
     210      19     198     201      20     198     204      20     372     375
       2     372     378       2     366     369       3     351     354      27
     351     357      27     342     345       7     324     327      34     315
     318      15     306     309      19     297     300      20     297     303
      20     471     474       2     471     477       2     465     468       3
     450     453      27     450     456      27     441     444       7     423
     426      34     414     417      15     405     408      19     396     399
      20     396     402      20     567     570       2     567     573       2
     561     564       3     549     552       7     531     534       2     531
     537       2     531     540       2     522     525      11     513     516
      15     504     507      19     495     498      20     495     501      20
     663     666       2     663     669       2     657     660       3     645
     648       7     627     630       2     627     633       2     627     636
       2     618     621      11     609     612      15     600     603      19
     591     594      20     591     597      20     759     762       2     759
     765       2     753     756       3     741     744      38     729     732
      27     729     735      27     714     717      41     705     708      15
     696     699      19     687     690      20     687     693      20     858
     861       2     858     864       2     852     855       3     837     840
      27     837     843      27     828     831       7     810     813      34
     801     804      15     792     795      19     783     786      20     783
     789      20     957     960       2     957     963       2     951     954
       3     936     939      27     936     942      27     927     930       7
     909     912      34     900     903      15     891     894      19     882
     885      20     882     888      20    1056    1059       2    1056    1062
       2    1050    1053       3    1035    1038      27    1035    1041      27
    1026    1029       7    1008    1011      34     999    1002      15     990
     993      19     981     984      20     981     987      20    1152    1155
       2    1152    1158       2    1146    1149       3    1134    1137       7
    1116    1119       2    1116    1122       2    1116    1125       2    1107
    1110      11    1098    1101      15    1089    1092      19    1080    1083
      20    1080    1086      20    1248    1251       2    1248    1254       2
    1242    1245       3    1230    1233       7    1212    1215       2    1212
    1218       2    1212    1221       2    1203    1206      11    1194    1197
      15    1185    1188      19    1176    1179      20    1176    1182      20
    1344    1347       2    1344    1350       2    1338    1341       3    1326
    1329      38    1314    1317      27    1314    1320      27    1299    1302
      41    1290    1293      15    1281    1284      19    1272    1275      20
    1272    1278      20    1443    1446       2    1443    1449       2    1437
    1440       3    1422    1425      27    1422    1428      27    1413    1416
       7    1395    1398      34    1386    1389      15    1377    1380      19
    1368    1371      20    1368    1374      20    1542    1545       2    1542
    1548       2    1536    1539       3    1521    1524      27    1521    1527
      27    1512    1515       7    1494    1497      34    1485    1488      15
    1476    1479      19    1467    1470      20    1467    1473      20    1641
    1644       2    1641    1647       2    1635    1638       3    1620    1623
      27    1620    1626      27    1611    1614       7    1593    1596      34
    1584    1587      15    1575    1578      19    1566    1569      20    1566
    1572      20    1737    1740       2    1737    1743       2    1731    1734
       3    1719    1722       7    1701    1704       2    1701    1707       2
    1701    1710       2    1692    1695      11    1683    1686      15    1674
    1677      19    1665    1668      20    1665    1671      20    1833    1836
       2    1833    1839       2    1827    1830       3    1815    1818       7
    1797    1800       2    1797    1803       2    1797    1806       2    1788
    1791      11    1779    1782      15    1770    1773      19    1761    1764
      20    1761    1767      20    1929    1932       2    1929    1935       2
    1923    1926       3    1911    1914      38    1899    1902      27    1899
    1905      27    1884    1887      41    1875    1878      15    1866    1869
      19    1857    1860      20    1857    1863      20    2031    2034       2
    2031    2037       2    2025    2028      19    2010    2013      27    2010
    2016      27    2001    2004       7    1986    1989       7    1971    1974
      15    1962    1965      19    1953    1956      19    1953    1959      19
    2130    2133       2    2130    2136       2    2124    2127       3    2109
    2112      27    2109    2115      27    2100    2103       7    2082    2085
      34    2073    2076      15    2064    2067      19    2055    2058      20
    2055    2061      20    2229    2232       2    2229    2235       2    2223
    2226       3    2208    2211      27    2208    2214      27    2199    2202
       7    2181    2184      34    2172    2175      15    2163    2166      19
    2154    2157      20    2154    2160      20    2334    2337      23    2325
    2328       2    2325    2331       2    2319    2322       3    2307    2310
      38    2295    2298      27    2295    2301      27    2280    2283      41
    2271    2274      15    2262    2265      19    2253    2256      20    2253
    2259      20
%FLAG BONDS_WITHOUT_HYDROGEN                                                    
%FORMAT(10I8)                                                                   
      87      90       1      72      78       4      72      87       5      66
      69       6      60      66       8      54      57       6      54      60
       8      39      42       9      39      54      10      33      39      12
      30      33      13      30      66      14      24      30      16      24
      78      17      21      24      18      15      21      18      15      72
       4       6      15      21       3       6      22     183     186       1
     168     174       4     168     183       5     162     165       6     156
     162       8     150     153       6     150     156       8     135     138
       9     135     150      10     129     135      12     126     129      13
     126     162      14     120     126      16     120     174      17     117
     120      18     111     117      18     111     168       4     102     111
      21      99     102      24      90      93      25      90      96      25
      90      99       1     282     285       1     267     273       4     267
     282       5     261     264      26     249     252      28     249     261
      29     243     249      30     237     240       6     237     243       8
     234     237      31     234     264      32     231     234      33     225
     231      35     222     225      36     222     264      37     216     222
      16     216     273      17     213     216      18     207     213      18
     207     267       4     198     207      21     195     198      24     186
     189      25     186     192      25     186     195       1     381     384
       1     366     372       4     366     381       5     360     363      26
     348     351      28     348     360      29     342     348      30     336
     339       6     336     342       8     333     336      31     333     363
      32     330     333      33     324     330      35     321     324      36
     321     363      37     315     321      16     315     372      17     312
     315      18     306     312      18     306     366       4     297     306
      21     294     297      24     285     288      25     285     291      25
     285     294       1     480     483       1     465     471       4     465
     480       5     459     462      26     447     450      28     447     459
      29     441     447      30     435     438       6     435     441       8
     432     435      31     432     462      32     429     432      33     423
     429      35     420     423      36     420     462      37     414     420
      16     414     471      17     411     414      18     405     411      18
     405     465       4     396     405      21     393     396      24     384
     387      25     384     390      25     384     393       1     576     579
       1     561     567       4     561     576       5     555     558       6
     549     555       8     543     546       6     543     549       8     528
     531       9     528     543      10     522     528      12     519     522
      13     519     555      14     513     519      16     513     567      17
     510     513      18     504     510      18     504     561       4     495
     504      21     492     495      24     483     486      25     483     489
      25     483     492       1     672     675       1     657     663       4
     657     672       5     651     654       6     645     651       8     639
     642       6     639     645       8     624     627       9     624     639
      10     618     624      12     615     618      13     615     651      14
     609     615      16     609     663      17     606     609      18     600
     606      18     600     657       4     591     600      21     588     591
      24     579     582      25     579     585      25     579     588       1
     768     771       1     753     759       4     753     768       5     747
     750      26     741     747      39     738     741      39     726     729
      28     726     738      29     723     726      40     723     750      32
     720     723      33     714     720      42     711     714      43     711
     750      37     705     711      16     705     759      17     702     705
      18     696     702      18     696     753       4     687     696      21
     684     687      24     675     678      25     675     681      25     675
     684       1     867     870       1     852     858       4     852     867
       5     846     849      26     834     837      28     834     846      29
     828     834      30     822     825       6     822     828       8     819
     822      31     819     849      32     816     819      33     810     816
      35     807     810      36     807     849      37     801     807      16
     801     858      17     798     801      18     792     798      18     792
     852       4     783     792      21     780     783      24     771     774
      25     771     777      25     771     780       1     966     969       1
     951     957       4     951     966       5     945     948      26     933
     936      28     933     945      29     927     933      30     921     924
       6     921     927       8     918     921      31     918     948      32
     915     918      33     909     915      35     906     909      36     906
     948      37     900     906      16     900     957      17     897     900
      18     891     897      18     891     951       4     882     891      21
     879     882      24     870     873      25     870     876      25     870
     879       1    1065    1068       1    1050    1056       4    1050    1065
       5    1044    1047      26    1032    1035      28    1032    1044      29
    1026    1032      30    1020    1023       6    1020    1026       8    1017
    1020      31    1017    1047      32    1014    1017      33    1008    1014
      35    1005    1008      36    1005    1047      37     999    1005      16
     999    1056      17     996     999      18     990     996      18     990
    1050       4     981     990      21     978     981      24     969     972
      25     969     975      25     969     978       1    1161    1164       1
    1146    1152       4    1146    1161       5    1140    1143       6    1134
    1140       8    1128    1131       6    1128    1134       8    1113    1116
       9    1113    1128      10    1107    1113      12    1104    1107      13
    1104    1140      14    1098    1104      16    1098    1152      17    1095
    1098      18    1089    1095      18    1089    1146       4    1080    1089
      21    1077    1080      24    1068    1071      25    1068    1074      25
    1068    1077       1    1257    1260       1    1242    1248       4    1242
    1257       5    1236    1239       6    1230    1236       8    1224    1227
       6    1224    1230       8    1209    1212       9    1209    1224      10
    1203    1209      12    1200    1203      13    1200    1236      14    1194
    1200      16    1194    1248      17    1191    1194      18    1185    1191
      18    1185    1242       4    1176    1185      21    1173    1176      24
    1164    1167      25    1164    1170      25    1164    1173       1    1353
    1356       1    1338    1344       4    1338    1353       5    1332    1335
      26    1326    1332      39    1323    1326      39    1311    1314      28
    1311    1323      29    1308    1311      40    1308    1335      32    1305
    1308      33    1299    1305      42    1296    1299      43    1296    1335
      37    1290    1296      16    1290    1344      17    1287    1290      18
    1281    1287      18    1281    1338       4    1272    1281      21    1269
    1272      24    1260    1263      25    1260    1266      25    1260    1269
       1    1452    1455       1    1437    1443       4    1437    1452       5
    1431    1434      26    1419    1422      28    1419    1431      29    1413
    1419      30    1407    1410       6    1407    1413       8    1404    1407
      31    1404    1434      32    1401    1404      33    1395    1401      35
    1392    1395      36    1392    1434      37    1386    1392      16    1386
    1443      17    1383    1386      18    1377    1383      18    1377    1437
       4    1368    1377      21    1365    1368      24    1356    1359      25
    1356    1362      25    1356    1365       1    1551    1554       1    1536
    1542       4    1536    1551       5    1530    1533      26    1518    1521
      28    1518    1530      29    1512    1518      30    1506    1509       6
    1506    1512       8    1503    1506      31    1503    1533      32    1500
    1503      33    1494    1500      35    1491    1494      36    1491    1533
      37    1485    1491      16    1485    1542      17    1482    1485      18
    1476    1482      18    1476    1536       4    1467    1476      21    1464
    1467      24    1455    1458      25    1455    1461      25    1455    1464
       1    1650    1653       1    1635    1641       4    1635    1650       5
    1629    1632      26    1617    1620      28    1617    1629      29    1611
    1617      30    1605    1608       6    1605    1611       8    1602    1605
      31    1602    1632      32    1599    1602      33    1593    1599      35
    1590    1593      36    1590    1632      37    1584    1590      16    1584
    1641      17    1581    1584      18    1575    1581      18    1575    1635
       4    1566    1575      21    1563    1566      24    1554    1557      25
    1554    1560      25    1554    1563       1    1746    1749       1    1731
    1737       4    1731    1746       5    1725    1728       6    1719    1725
       8    1713    1716       6    1713    1719       8    1698    1701       9
    1698    1713      10    1692    1698      12    1689    1692      13    1689
    1725      14    1683    1689      16    1683    1737      17    1680    1683
      18    1674    1680      18    1674    1731       4    1665    1674      21
    1662    1665      24    1653    1656      25    1653    1659      25    1653
    1662       1    1842    1845       1    1827    1833       4    1827    1842
       5    1821    1824       6    1815    1821       8    1809    1812       6
    1809    1815       8    1794    1797       9    1794    1809      10    1788
    1794      12    1785    1788      13    1785    1821      14    1779    1785
      16    1779    1833      17    1776    1779      18    1770    1776      18
    1770    1827       4    1761    1770      21    1758    1761      24    1749
    1752      25    1749    1755      25    1749    1758       1    1938    1941
       1    1923    1929       4    1923    1938       5    1917    1920      26
    1911    1917      39    1908    1911      39    1896    1899      28    1896
    1908      29    1893    1896      40    1893    1920      32    1890    1893
      33    1884    1890      42    1881    1884      43    1881    1920      37
    1875    1881      16    1875    1929      17    1872    1875      18    1866
    1872      18    1866    1923       4    1857    1866      21    1854    1857
      24    1845    1848      25    1845    1851      25    1845    1854       1
    2040    2043       1    2025    2031      17    2025    2040      18    2019
    2022      26    2007    2010      28    2007    2019      29    2001    2007
      30    1995    1998       6    1995    2001       8    1992    1995      31
    1992    2022      32    1986    1992      44    1980    1983      45    1980
    1986      46    1977    1980      36    1977    2022      37    1971    1977
      16    1971    2031      17    1968    1971      18    1962    1968      18
    1962    2025      17    1953    1962      17    1950    1953      18    1941
    1944      25    1941    1947      25    1941    1950       1    2139    2142
       1    2124    2130       4    2124    2139       5    2118    2121      26
    2106    2109      28    2106    2118      29    2100    2106      30    2094
    2097       6    2094    2100       8    2091    2094      31    2091    2121
      32    2088    2091      33    2082    2088      35    2079    2082      36
    2079    2121      37    2073    2079      16    2073    2130      17    2070
    2073      18    2064    2070      18    2064    2124       4    2055    2064
      21    2052    2055      24    2043    2046      25    2043    2049      25
    2043    2052       1    2238    2241       1    2223    2229       4    2223
    2238       5    2217    2220      26    2205    2208      28    2205    2217
      29    2199    2205      30    2193    2196       6    2193    2199       8
    2190    2193      31    2190    2220      32    2187    2190      33    2181
    2187      35    2178    2181      36    2178    2220      37    2172    2178
      16    2172    2229      17    2169    2172      18    2163    2169      18
    2163    2223       4    2154    2163      21    2151    2154      24    2142
    2145      25    2142    2148      25    2142    2151       1    2319    2325
       4    2319    2334      47    2313    2316      26    2307    2313      39
    2304    2307      39    2292    2295      28    2292    2304      29    2289
    2292      40    2289    2316      32    2286    2289      33    2280    2286
      42    2277    2280      43    2277    2316      37    2271    2277      16
    2271    2325      17    2268    2271      18    2262    2268      18    2262
    2319       4    2253    2262      21    2250    2253      24    2241    2244
      25    2241    2247      25    2241    2250       1
%FLAG ANGLES_INC_HYDROGEN                                                       
%FORMAT(10I8)                                                                   
      81      78      84       3      75      72      78       5      75      72
      87       6      72      78      81       7      72      78      84       7
      63      60      66       9      54      60      63       9      48      42
      51       3      45      42      48       3      45      42      51       3
      39      42      45      13      39      42      48      13      39      42
      51      13      36      33      39      16      30      33      36      21
      27      24      30      25      27      24      78      26      24      78
      81      30      24      78      84      30      21      24      27      32
      18      15      21      35      18      15      72      36      15      72
      75       5      12       6      15      39       9       6      12      40
       9       6      15      39       6      15      18      41       3       6
       9      44       3       6      12      44       0       3       6      46
     177     174     180       3     171     168     174       5     171     168
     183       6     168     174     177       7     168     174     180       7
     159     156     162       9     150     156     159       9     144     138
     147       3     141     138     144       3     141     138     147       3
     135     138     141      13     135     138     144      13     135     138
     147      13     132     129     135      16     126     129     132      21
     123     120     126      25     123     120     174      26     120     174
     177      30     120     174     180      30     117     120     123      32
     114     111     117      35     114     111     168      36     111     168
     171       5     108     102     111      39     105     102     108      40
     105     102     111      39     102     111     114      41      99     102
     105      47      99     102     108      47     276     273     279       3
     270     267     273       5     270     267     282       6     267     273
     276       7     267     273     279       7     255     252     258      51
     249     252     255      53     249     252     258      53     246     243
     249      55     237     243     246       9     228     225     231      65
     222     225     228      68     219     216     222      25     219     216
     273      26     216     273     276      30     216     273     279      30
     213     216     219      32     210     207     213      35     210     207
     267      36     207     267     270       5     204     198     207      39
     201     198     204      40     201     198     207      39     198     207
     210      41     195     198     201      47     195     198     204      47
     375     372     378       3     369     366     372       5     369     366
     381       6     366     372     375       7     366     372     378       7
     354     351     357      51     348     351     354      53     348     351
     357      53     345     342     348      55     336     342     345       9
     327     324     330      65     321     324     327      68     318     315
     321      25     318     315     372      26     315     372     375      30
     315     372     378      30     312     315     318      32     309     306
     312      35     309     306     366      36     306     366     369       5
     303     297     306      39     300     297     303      40     300     297
     306      39     297     306     309      41     294     297     300      47
     294     297     303      47     474     471     477       3     468     465
     471       5     468     465     480       6     465     471     474       7
     465     471     477       7     453     450     456      51     447     450
     453      53     447     450     456      53     444     441     447      55
     435     441     444       9     426     423     429      65     420     423
     426      68     417     414     420      25     417     414     471      26
     414     471     474      30     414     471     477      30     411     414
     417      32     408     405     411      35     408     405     465      36
     405     465     468       5     402     396     405      39     399     396
     402      40     399     396     405      39     396     405     408      41
     393     396     399      47     393     396     402      47     570     567
     573       3     564     561     567       5     564     561     576       6
     561     567     570       7     561     567     573       7     552     549
     555       9     543     549     552       9     537     531     540       3
     534     531     537       3     534     531     540       3     528     531
     534      13     528     531     537      13     528     531     540      13
     525     522     528      16     519     522     525      21     516     513
     519      25     516     513     567      26     513     567     570      30
     513     567     573      30     510     513     516      32     507     504
     510      35     507     504     561      36     504     561     564       5
     501     495     504      39     498     495     501      40     498     495
     504      39     495     504     507      41     492     495     498      47
     492     495     501      47     666     663     669       3     660     657
     663       5     660     657     672       6     657     663     666       7
     657     663     669       7     648     645     651       9     639     645
     648       9     633     627     636       3     630     627     633       3
     630     627     636       3     624     627     630      13     624     627
     633      13     624     627     636      13     621     618     624      16
     615     618     621      21     612     609     615      25     612     609
     663      26     609     663     666      30     609     663     669      30
     606     609     612      32     603     600     606      35     603     600
     657      36     600     657     660       5     597     591     600      39
     594     591     597      40     594     591     600      39     591     600
     603      41     588     591     594      47     588     591     597      47
     762     759     765       3     756     753     759       5     756     753
     768       6     753     759     762       7     753     759     765       7
     744     741     747      74     738     741     744      74     732     729
     735      51     726     729     732      53     726     729     735      53
     717     714     720      82     711     714     717      85     708     705
     711      25     708     705     759      26     705     759     762      30
     705     759     765      30     702     705     708      32     699     696
     702      35     699     696     753      36     696     753     756       5
     693     687     696      39     690     687     693      40     690     687
     696      39     687     696     699      41     684     687     690      47
     684     687     693      47     861     858     864       3     855     852
     858       5     855     852     867       6     852     858     861       7
     852     858     864       7     840     837     843      51     834     837
     840      53     834     837     843      53     831     828     834      55
     822     828     831       9     813     810     816      65     807     810
     813      68     804     801     807      25     804     801     858      26
     801     858     861      30     801     858     864      30     798     801
     804      32     795     792     798      35     795     792     852      36
     792     852     855       5     789     783     792      39     786     783
     789      40     786     783     792      39     783     792     795      41
     780     783     786      47     780     783     789      47     960     957
     963       3     954     951     957       5     954     951     966       6
     951     957     960       7     951     957     963       7     939     936
     942      51     933     936     939      53     933     936     942      53
     930     927     933      55     921     927     930       9     912     909
     915      65     906     909     912      68     903     900     906      25
     903     900     957      26     900     957     960      30     900     957
     963      30     897     900     903      32     894     891     897      35
     894     891     951      36     891     951     954       5     888     882
     891      39     885     882     888      40     885     882     891      39
     882     891     894      41     879     882     885      47     879     882
     888      47    1059    1056    1062       3    1053    1050    1056       5
    1053    1050    1065       6    1050    1056    1059       7    1050    1056
    1062       7    1038    1035    1041      51    1032    1035    1038      53
    1032    1035    1041      53    1029    1026    1032      55    1020    1026
    1029       9    1011    1008    1014      65    1005    1008    1011      68
    1002     999    1005      25    1002     999    1056      26     999    1056
    1059      30     999    1056    1062      30     996     999    1002      32
     993     990     996      35     993     990    1050      36     990    1050
    1053       5     987     981     990      39     984     981     987      40
     984     981     990      39     981     990     993      41     978     981
     984      47     978     981     987      47    1155    1152    1158       3
    1149    1146    1152       5    1149    1146    1161       6    1146    1152
    1155       7    1146    1152    1158       7    1137    1134    1140       9
    1128    1134    1137       9    1122    1116    1125       3    1119    1116
    1122       3    1119    1116    1125       3    1113    1116    1119      13
    1113    1116    1122      13    1113    1116    1125      13    1110    1107
    1113      16    1104    1107    1110      21    1101    1098    1104      25
    1101    1098    1152      26    1098    1152    1155      30    1098    1152
    1158      30    1095    1098    1101      32    1092    1089    1095      35
    1092    1089    1146      36    1089    1146    1149       5    1086    1080
    1089      39    1083    1080    1086      40    1083    1080    1089      39
    1080    1089    1092      41    1077    1080    1083      47    1077    1080
    1086      47    1251    1248    1254       3    1245    1242    1248       5
    1245    1242    1257       6    1242    1248    1251       7    1242    1248
    1254       7    1233    1230    1236       9    1224    1230    1233       9
    1218    1212    1221       3    1215    1212    1218       3    1215    1212
    1221       3    1209    1212    1215      13    1209    1212    1218      13
    1209    1212    1221      13    1206    1203    1209      16    1200    1203
    1206      21    1197    1194    1200      25    1197    1194    1248      26
    1194    1248    1251      30    1194    1248    1254      30    1191    1194
    1197      32    1188    1185    1191      35    1188    1185    1242      36
    1185    1242    1245       5    1182    1176    1185      39    1179    1176
    1182      40    1179    1176    1185      39    1176    1185    1188      41
    1173    1176    1179      47    1173    1176    1182      47    1347    1344
    1350       3    1341    1338    1344       5    1341    1338    1353       6
    1338    1344    1347       7    1338    1344    1350       7    1329    1326
    1332      74    1323    1326    1329      74    1317    1314    1320      51
    1311    1314    1317      53    1311    1314    1320      53    1302    1299
    1305      82    1296    1299    1302      85    1293    1290    1296      25
    1293    1290    1344      26    1290    1344    1347      30    1290    1344
    1350      30    1287    1290    1293      32    1284    1281    1287      35
    1284    1281    1338      36    1281    1338    1341       5    1278    1272
    1281      39    1275    1272    1278      40    1275    1272    1281      39
    1272    1281    1284      41    1269    1272    1275      47    1269    1272
    1278      47    1446    1443    1449       3    1440    1437    1443       5
    1440    1437    1452       6    1437    1443    1446       7    1437    1443
    1449       7    1425    1422    1428      51    1419    1422    1425      53
    1419    1422    1428      53    1416    1413    1419      55    1407    1413
    1416       9    1398    1395    1401      65    1392    1395    1398      68
    1389    1386    1392      25    1389    1386    1443      26    1386    1443
    1446      30    1386    1443    1449      30    1383    1386    1389      32
    1380    1377    1383      35    1380    1377    1437      36    1377    1437
    1440       5    1374    1368    1377      39    1371    1368    1374      40
    1371    1368    1377      39    1368    1377    1380      41    1365    1368
    1371      47    1365    1368    1374      47    1545    1542    1548       3
    1539    1536    1542       5    1539    1536    1551       6    1536    1542
    1545       7    1536    1542    1548       7    1524    1521    1527      51
    1518    1521    1524      53    1518    1521    1527      53    1515    1512
    1518      55    1506    1512    1515       9    1497    1494    1500      65
    1491    1494    1497      68    1488    1485    1491      25    1488    1485
    1542      26    1485    1542    1545      30    1485    1542    1548      30
    1482    1485    1488      32    1479    1476    1482      35    1479    1476
    1536      36    1476    1536    1539       5    1473    1467    1476      39
    1470    1467    1473      40    1470    1467    1476      39    1467    1476
    1479      41    1464    1467    1470      47    1464    1467    1473      47
    1644    1641    1647       3    1638    1635    1641       5    1638    1635
    1650       6    1635    1641    1644       7    1635    1641    1647       7
    1623    1620    1626      51    1617    1620    1623      53    1617    1620
    1626      53    1614    1611    1617      55    1605    1611    1614       9
    1596    1593    1599      65    1590    1593    1596      68    1587    1584
    1590      25    1587    1584    1641      26    1584    1641    1644      30
    1584    1641    1647      30    1581    1584    1587      32    1578    1575
    1581      35    1578    1575    1635      36    1575    1635    1638       5
    1572    1566    1575      39    1569    1566    1572      40    1569    1566
    1575      39    1566    1575    1578      41    1563    1566    1569      47
    1563    1566    1572      47    1740    1737    1743       3    1734    1731
    1737       5    1734    1731    1746       6    1731    1737    1740       7
    1731    1737    1743       7    1722    1719    1725       9    1713    1719
    1722       9    1707    1701    1710       3    1704    1701    1707       3
    1704    1701    1710       3    1698    1701    1704      13    1698    1701
    1707      13    1698    1701    1710      13    1695    1692    1698      16
    1689    1692    1695      21    1686    1683    1689      25    1686    1683
    1737      26    1683    1737    1740      30    1683    1737    1743      30
    1680    1683    1686      32    1677    1674    1680      35    1677    1674
    1731      36    1674    1731    1734       5    1671    1665    1674      39
    1668    1665    1671      40    1668    1665    1674      39    1665    1674
    1677      41    1662    1665    1668      47    1662    1665    1671      47
    1836    1833    1839       3    1830    1827    1833       5    1830    1827
    1842       6    1827    1833    1836       7    1827    1833    1839       7
    1818    1815    1821       9    1809    1815    1818       9    1803    1797
    1806       3    1800    1797    1803       3    1800    1797    1806       3
    1794    1797    1800      13    1794    1797    1803      13    1794    1797
    1806      13    1791    1788    1794      16    1785    1788    1791      21
    1782    1779    1785      25    1782    1779    1833      26    1779    1833
    1836      30    1779    1833    1839      30    1776    1779    1782      32
    1773    1770    1776      35    1773    1770    1827      36    1770    1827
    1830       5    1767    1761    1770      39    1764    1761    1767      40
    1764    1761    1770      39    1761    1770    1773      41    1758    1761
    1764      47    1758    1761    1767      47    1932    1929    1935       3
    1926    1923    1929       5    1926    1923    1938       6    1923    1929
    1932       7    1923    1929    1935       7    1914    1911    1917      74
    1908    1911    1914      74    1902    1899    1905      51    1896    1899
    1902      53    1896    1899    1905      53    1887    1884    1890      82
    1881    1884    1887      85    1878    1875    1881      25    1878    1875
    1929      26    1875    1929    1932      30    1875    1929    1935      30
    1872    1875    1878      32    1869    1866    1872      35    1869    1866
    1923      36    1866    1923    1926       5    1863    1857    1866      39
    1860    1857    1863      40    1860    1857    1866      39    1857    1866
    1869      41    1854    1857    1860      47    1854    1857    1863      47
    2034    2031    2037       3    2028    2025    2031      88    2028    2025
    2040      35    2025    2031    2034      30    2025    2031    2037      30
    2013    2010    2016      51    2007    2010    2013      53    2007    2010
    2016      53    2004    2001    2007      55    1995    2001    2004       9
    1989    1986    1992      90    1980    1986    1989      94    1974    1971
    1977      25    1974    1971    2031      26    1971    2031    2034      30
    1971    2031    2037      30    1968    1971    1974      32    1965    1962
    1968      35    1965    1962    2025      88    1962    2025    2028      88
    1959    1953    1962      88    1956    1953    1959      99    1956    1953
    1962      88    1953    1962    1965      88    1950    1953    1956      35
    1950    1953    1959      35    2133    2130    2136       3    2127    2124
    2130       5    2127    2124    2139       6    2124    2130    2133       7
    2124    2130    2136       7    2112    2109    2115      51    2106    2109
    2112      53    2106    2109    2115      53    2103    2100    2106      55
    2094    2100    2103       9    2085    2082    2088      65    2079    2082
    2085      68    2076    2073    2079      25    2076    2073    2130      26
    2073    2130    2133      30    2073    2130    2136      30    2070    2073
    2076      32    2067    2064    2070      35    2067    2064    2124      36
    2064    2124    2127       5    2061    2055    2064      39    2058    2055
    2061      40    2058    2055    2064      39    2055    2064    2067      41
    2052    2055    2058      47    2052    2055    2061      47    2232    2229
    2235       3    2226    2223    2229       5    2226    2223    2238       6
    2223    2229    2232       7    2223    2229    2235       7    2211    2208
    2214      51    2205    2208    2211      53    2205    2208    2214      53
    2202    2199    2205      55    2193    2199    2202       9    2184    2181
    2187      65    2178    2181    2184      68    2175    2172    2178      25
    2175    2172    2229      26    2172    2229    2232      30    2172    2229
    2235      30    2169    2172    2175      32    2166    2163    2169      35
    2166    2163    2223      36    2163    2223    2226       5    2160    2154
    2163      39    2157    2154    2160      40    2157    2154    2163      39
    2154    2163    2166      41    2151    2154    2157      47    2151    2154
    2160      47    2328    2325    2331       3    2322    2319    2325       5
    2322    2319    2334     101    2319    2325    2328       7    2319    2325
    2331       7    2319    2334    2337     102    2310    2307    2313      74
    2304    2307    2310      74    2298    2295    2301      51    2292    2295
    2298      53    2292    2295    2301      53    2283    2280    2286      82
    2277    2280    2283      85    2274    2271    2277      25    2274    2271
    2325      26    2271    2325    2328      30    2271    2325    2331      30
    2268    2271    2274      32    2265    2262    2268      35    2265    2262
    2319      36    2262    2319    2322       5    2259    2253    2262      39
    2256    2253    2259      40    2256    2253    2262      39    2253    2262
    2265      41    2250    2253    2256      47    2250    2253    2259      47
%FLAG ANGLES_WITHOUT_HYDROGEN                                                   
%FORMAT(10I8)                                                                   
      87      90      93       1      87      90      96       1      87      90
      99       2      78      72      87       4      72      87      90       8
      60      66      69      10      57      54      60      10      54      60
      66      11      42      39      54      12      39      54      57      14
      39      54      60      15      33      30      66      17      33      39
      42      18      33      39      54      19      30      24      78      20
      30      33      39      22      30      66      60      23      30      66
      69      24      24      30      33      27      24      30      66      28
      24      78      72      29      21      15      72      31      21      24
      30      33      21      24      78      34      15      21      24      37
      15      72      78      38      15      72      87       4       6      15
      21      42       6      15      72      43       3       6      15      45
     183     186     189       1     183     186     192       1     183     186
     195       2     174     168     183       4     168     183     186       8
     156     162     165      10     153     150     156      10     150     156
     162      11     138     135     150      12     135     150     153      14
     135     150     156      15     129     126     162      17     129     135
     138      18     129     135     150      19     126     120     174      20
     126     129     135      22     126     162     156      23     126     162
     165      24     120     126     129      27     120     126     162      28
     120     174     168      29     117     111     168      31     117     120
     126      33     117     120     174      34     111     117     120      37
     111     168     174      38     111     168     183       4     102     111
     117      42     102     111     168      43      99     102     111      48
      96      90      99       1      93      90      96      49      93      90
      99       1      90      99     102      50     282     285     288       1
     282     285     291       1     282     285     294       2     273     267
     282       4     267     282     285       8     252     249     261      52
     249     261     264      54     243     249     252      56     243     249
     261      57     240     237     243      10     237     234     264      58
     237     243     249      59     234     237     240      60     234     237
     243      61     234     264     261      62     231     234     237      63
     231     234     264      64     225     222     264      66     225     231
     234      67     222     216     273      20     222     225     231      69
     222     264     234      70     222     264     261      71     216     222
     225      72     216     222     264      73     216     273     267      29
     213     207     267      31     213     216     222      33     213     216
     273      34     207     213     216      37     207     267     273      38
     207     267     282       4     198     207     213      42     198     207
     267      43     195     198     207      48     192     186     195       1
     189     186     192      49     189     186     195       1     186     195
     198      50     381     384     387       1     381     384     390       1
     381     384     393       2     372     366     381       4     366     381
     384       8     351     348     360      52     348     360     363      54
     342     348     351      56     342     348     360      57     339     336
     342      10     336     333     363      58     336     342     348      59
     333     336     339      60     333     336     342      61     333     363
     360      62     330     333     336      63     330     333     363      64
     324     321     363      66     324     330     333      67     321     315
     372      20     321     324     330      69     321     363     333      70
     321     363     360      71     315     321     324      72     315     321
     363      73     315     372     366      29     312     306     366      31
     312     315     321      33     312     315     372      34     306     312
     315      37     306     366     372      38     306     366     381       4
     297     306     312      42     297     306     366      43     294     297
     306      48     291     285     294       1     288     285     291      49
     288     285     294       1     285     294     297      50     480     483
     486       1     480     483     489       1     480     483     492       2
     471     465     480       4     465     480     483       8     450     447
     459      52     447     459     462      54     441     447     450      56
     441     447     459      57     438     435     441      10     435     432
     462      58     435     441     447      59     432     435     438      60
     432     435     441      61     432     462     459      62     429     432
     435      63     429     432     462      64     423     420     462      66
     423     429     432      67     420     414     471      20     420     423
     429      69     420     462     432      70     420     462     459      71
     414     420     423      72     414     420     462      73     414     471
     465      29     411     405     465      31     411     414     420      33
     411     414     471      34     405     411     414      37     405     465
     471      38     405     465     480       4     396     405     411      42
     396     405     465      43     393     396     405      48     390     384
     393       1     387     384     390      49     387     384     393       1
     384     393     396      50     576     579     582       1     576     579
     585       1     576     579     588       2     567     561     576       4
     561     576     579       8     549     555     558      10     546     543
     549      10     543     549     555      11     531     528     543      12
     528     543     546      14     528     543     549      15     522     519
     555      17     522     528     531      18     522     528     543      19
     519     513     567      20     519     522     528      22     519     555
     549      23     519     555     558      24     513     519     522      27
     513     519     555      28     513     567     561      29     510     504
     561      31     510     513     519      33     510     513     567      34
     504     510     513      37     504     561     567      38     504     561
     576       4     495     504     510      42     495     504     561      43
     492     495     504      48     489     483     492       1     486     483
     489      49     486     483     492       1     483     492     495      50
     672     675     678       1     672     675     681       1     672     675
     684       2     663     657     672       4     657     672     675       8
     645     651     654      10     642     639     645      10     639     645
     651      11     627     624     639      12     624     639     642      14
     624     639     645      15     618     615     651      17     618     624
     627      18     618     624     639      19     615     609     663      20
     615     618     624      22     615     651     645      23     615     651
     654      24     609     615     618      27     609     615     651      28
     609     663     657      29     606     600     657      31     606     609
     615      33     606     609     663      34     600     606     609      37
     600     657     663      38     600     657     672       4     591     600
     606      42     591     600     657      43     588     591     600      48
     585     579     588       1     582     579     585      49     582     579
     588       1     579     588     591      50     768     771     774       1
     768     771     777       1     768     771     780       2     759     753
     768       4     753     768     771       8     741     747     750      75
     738     741     747      76     729     726     738      52     726     723
     750      77     726     738     741      78     723     726     729      79
     723     726     738      80     723     750     747      62     720     723
     726      81     720     723     750      64     714     711     750      83
     714     720     723      84     711     705     759      20     711     714
     720      86     711     750     723      70     711     750     747      71
     705     711     714      87     705     711     750      73     705     759
     753      29     702     696     753      31     702     705     711      33
     702     705     759      34     696     702     705      37     696     753
     759      38     696     753     768       4     687     696     702      42
     687     696     753      43     684     687     696      48     681     675
     684       1     678     675     681      49     678     675     684       1
     675     684     687      50     867     870     873       1     867     870
     876       1     867     870     879       2     858     852     867       4
     852     867     870       8     837     834     846      52     834     846
     849      54     828     834     837      56     828     834     846      57
     825     822     828      10     822     819     849      58     822     828
     834      59     819     822     825      60     819     822     828      61
     819     849     846      62     816     819     822      63     816     819
     849      64     810     807     849      66     810     816     819      67
     807     801     858      20     807     810     816      69     807     849
     819      70     807     849     846      71     801     807     810      72
     801     807     849      73     801     858     852      29     798     792
     852      31     798     801     807      33     798     801     858      34
     792     798     801      37     792     852     858      38     792     852
     867       4     783     792     798      42     783     792     852      43
     780     783     792      48     777     771     780       1     774     771
     777      49     774     771     780       1     771     780     783      50
     966     969     972       1     966     969     975       1     966     969
     978       2     957     951     966       4     951     966     969       8
     936     933     945      52     933     945     948      54     927     933
     936      56     927     933     945      57     924     921     927      10
     921     918     948      58     921     927     933      59     918     921
     924      60     918     921     927      61     918     948     945      62
     915     918     921      63     915     918     948      64     909     906
     948      66     909     915     918      67     906     900     957      20
     906     909     915      69     906     948     918      70     906     948
     945      71     900     906     909      72     900     906     948      73
     900     957     951      29     897     891     951      31     897     900
     906      33     897     900     957      34     891     897     900      37
     891     951     957      38     891     951     966       4     882     891
     897      42     882     891     951      43     879     882     891      48
     876     870     879       1     873     870     876      49     873     870
     879       1     870     879     882      50    1065    1068    1071       1
    1065    1068    1074       1    1065    1068    1077       2    1056    1050
    1065       4    1050    1065    1068       8    1035    1032    1044      52
    1032    1044    1047      54    1026    1032    1035      56    1026    1032
    1044      57    1023    1020    1026      10    1020    1017    1047      58
    1020    1026    1032      59    1017    1020    1023      60    1017    1020
    1026      61    1017    1047    1044      62    1014    1017    1020      63
    1014    1017    1047      64    1008    1005    1047      66    1008    1014
    1017      67    1005     999    1056      20    1005    1008    1014      69
    1005    1047    1017      70    1005    1047    1044      71     999    1005
    1008      72     999    1005    1047      73     999    1056    1050      29
     996     990    1050      31     996     999    1005      33     996     999
    1056      34     990     996     999      37     990    1050    1056      38
     990    1050    1065       4     981     990     996      42     981     990
    1050      43     978     981     990      48     975     969     978       1
     972     969     975      49     972     969     978       1     969     978
     981      50    1161    1164    1167       1    1161    1164    1170       1
    1161    1164    1173       2    1152    1146    1161       4    1146    1161
    1164       8    1134    1140    1143      10    1131    1128    1134      10
    1128    1134    1140      11    1116    1113    1128      12    1113    1128
    1131      14    1113    1128    1134      15    1107    1104    1140      17
    1107    1113    1116      18    1107    1113    1128      19    1104    1098
    1152      20    1104    1107    1113      22    1104    1140    1134      23
    1104    1140    1143      24    1098    1104    1107      27    1098    1104
    1140      28    1098    1152    1146      29    1095    1089    1146      31
    1095    1098    1104      33    1095    1098    1152      34    1089    1095
    1098      37    1089    1146    1152      38    1089    1146    1161       4
    1080    1089    1095      42    1080    1089    1146      43    1077    1080
    1089      48    1074    1068    1077       1    1071    1068    1074      49
    1071    1068    1077       1    1068    1077    1080      50    1257    1260
    1263       1    1257    1260    1266       1    1257    1260    1269       2
    1248    1242    1257       4    1242    1257    1260       8    1230    1236
    1239      10    1227    1224    1230      10    1224    1230    1236      11
    1212    1209    1224      12    1209    1224    1227      14    1209    1224
    1230      15    1203    1200    1236      17    1203    1209    1212      18
    1203    1209    1224      19    1200    1194    1248      20    1200    1203
    1209      22    1200    1236    1230      23    1200    1236    1239      24
    1194    1200    1203      27    1194    1200    1236      28    1194    1248
    1242      29    1191    1185    1242      31    1191    1194    1200      33
    1191    1194    1248      34    1185    1191    1194      37    1185    1242
    1248      38    1185    1242    1257       4    1176    1185    1191      42
    1176    1185    1242      43    1173    1176    1185      48    1170    1164
    1173       1    1167    1164    1170      49    1167    1164    1173       1
    1164    1173    1176      50    1353    1356    1359       1    1353    1356
    1362       1    1353    1356    1365       2    1344    1338    1353       4
    1338    1353    1356       8    1326    1332    1335      75    1323    1326
    1332      76    1314    1311    1323      52    1311    1308    1335      77
    1311    1323    1326      78    1308    1311    1314      79    1308    1311
    1323      80    1308    1335    1332      62    1305    1308    1311      81
    1305    1308    1335      64    1299    1296    1335      83    1299    1305
    1308      84    1296    1290    1344      20    1296    1299    1305      86
    1296    1335    1308      70    1296    1335    1332      71    1290    1296
    1299      87    1290    1296    1335      73    1290    1344    1338      29
    1287    1281    1338      31    1287    1290    1296      33    1287    1290
    1344      34    1281    1287    1290      37    1281    1338    1344      38
    1281    1338    1353       4    1272    1281    1287      42    1272    1281
    1338      43    1269    1272    1281      48    1266    1260    1269       1
    1263    1260    1266      49    1263    1260    1269       1    1260    1269
    1272      50    1452    1455    1458       1    1452    1455    1461       1
    1452    1455    1464       2    1443    1437    1452       4    1437    1452
    1455       8    1422    1419    1431      52    1419    1431    1434      54
    1413    1419    1422      56    1413    1419    1431      57    1410    1407
    1413      10    1407    1404    1434      58    1407    1413    1419      59
    1404    1407    1410      60    1404    1407    1413      61    1404    1434
    1431      62    1401    1404    1407      63    1401    1404    1434      64
    1395    1392    1434      66    1395    1401    1404      67    1392    1386
    1443      20    1392    1395    1401      69    1392    1434    1404      70
    1392    1434    1431      71    1386    1392    1395      72    1386    1392
    1434      73    1386    1443    1437      29    1383    1377    1437      31
    1383    1386    1392      33    1383    1386    1443      34    1377    1383
    1386      37    1377    1437    1443      38    1377    1437    1452       4
    1368    1377    1383      42    1368    1377    1437      43    1365    1368
    1377      48    1362    1356    1365       1    1359    1356    1362      49
    1359    1356    1365       1    1356    1365    1368      50    1551    1554
    1557       1    1551    1554    1560       1    1551    1554    1563       2
    1542    1536    1551       4    1536    1551    1554       8    1521    1518
    1530      52    1518    1530    1533      54    1512    1518    1521      56
    1512    1518    1530      57    1509    1506    1512      10    1506    1503
    1533      58    1506    1512    1518      59    1503    1506    1509      60
    1503    1506    1512      61    1503    1533    1530      62    1500    1503
    1506      63    1500    1503    1533      64    1494    1491    1533      66
    1494    1500    1503      67    1491    1485    1542      20    1491    1494
    1500      69    1491    1533    1503      70    1491    1533    1530      71
    1485    1491    1494      72    1485    1491    1533      73    1485    1542
    1536      29    1482    1476    1536      31    1482    1485    1491      33
    1482    1485    1542      34    1476    1482    1485      37    1476    1536
    1542      38    1476    1536    1551       4    1467    1476    1482      42
    1467    1476    1536      43    1464    1467    1476      48    1461    1455
    1464       1    1458    1455    1461      49    1458    1455    1464       1
    1455    1464    1467      50    1650    1653    1656       1    1650    1653
    1659       1    1650    1653    1662       2    1641    1635    1650       4
    1635    1650    1653       8    1620    1617    1629      52    1617    1629
    1632      54    1611    1617    1620      56    1611    1617    1629      57
    1608    1605    1611      10    1605    1602    1632      58    1605    1611
    1617      59    1602    1605    1608      60    1602    1605    1611      61
    1602    1632    1629      62    1599    1602    1605      63    1599    1602
    1632      64    1593    1590    1632      66    1593    1599    1602      67
    1590    1584    1641      20    1590    1593    1599      69    1590    1632
    1602      70    1590    1632    1629      71    1584    1590    1593      72
    1584    1590    1632      73    1584    1641    1635      29    1581    1575
    1635      31    1581    1584    1590      33    1581    1584    1641      34
    1575    1581    1584      37    1575    1635    1641      38    1575    1635
    1650       4    1566    1575    1581      42    1566    1575    1635      43
    1563    1566    1575      48    1560    1554    1563       1    1557    1554
    1560      49    1557    1554    1563       1    1554    1563    1566      50
    1746    1749    1752       1    1746    1749    1755       1    1746    1749
    1758       2    1737    1731    1746       4    1731    1746    1749       8
    1719    1725    1728      10    1716    1713    1719      10    1713    1719
    1725      11    1701    1698    1713      12    1698    1713    1716      14
    1698    1713    1719      15    1692    1689    1725      17    1692    1698
    1701      18    1692    1698    1713      19    1689    1683    1737      20
    1689    1692    1698      22    1689    1725    1719      23    1689    1725
    1728      24    1683    1689    1692      27    1683    1689    1725      28
    1683    1737    1731      29    1680    1674    1731      31    1680    1683
    1689      33    1680    1683    1737      34    1674    1680    1683      37
    1674    1731    1737      38    1674    1731    1746       4    1665    1674
    1680      42    1665    1674    1731      43    1662    1665    1674      48
    1659    1653    1662       1    1656    1653    1659      49    1656    1653
    1662       1    1653    1662    1665      50    1842    1845    1848       1
    1842    1845    1851       1    1842    1845    1854       2    1833    1827
    1842       4    1827    1842    1845       8    1815    1821    1824      10
    1812    1809    1815      10    1809    1815    1821      11    1797    1794
    1809      12    1794    1809    1812      14    1794    1809    1815      15
    1788    1785    1821      17    1788    1794    1797      18    1788    1794
    1809      19    1785    1779    1833      20    1785    1788    1794      22
    1785    1821    1815      23    1785    1821    1824      24    1779    1785
    1788      27    1779    1785    1821      28    1779    1833    1827      29
    1776    1770    1827      31    1776    1779    1785      33    1776    1779
    1833      34    1770    1776    1779      37    1770    1827    1833      38
    1770    1827    1842       4    1761    1770    1776      42    1761    1770
    1827      43    1758    1761    1770      48    1755    1749    1758       1
    1752    1749    1755      49    1752    1749    1758       1    1749    1758
    1761      50    1938    1941    1944       1    1938    1941    1947       1
    1938    1941    1950       2    1929    1923    1938       4    1923    1938
    1941       8    1911    1917    1920      75    1908    1911    1917      76
    1899    1896    1908      52    1896    1893    1920      77    1896    1908
    1911      78    1893    1896    1899      79    1893    1896    1908      80
    1893    1920    1917      62    1890    1893    1896      81    1890    1893
    1920      64    1884    1881    1920      83    1884    1890    1893      84
    1881    1875    1929      20    1881    1884    1890      86    1881    1920
    1893      70    1881    1920    1917      71    1875    1881    1884      87
    1875    1881    1920      73    1875    1929    1923      29    1872    1866
    1923      31    1872    1875    1881      33    1872    1875    1929      34
    1866    1872    1875      37    1866    1923    1929      38    1866    1923
    1938       4    1857    1866    1872      42    1857    1866    1923      43
    1854    1857    1866      48    1851    1845    1854       1    1848    1845
    1851      49    1848    1845    1854       1    1845    1854    1857      50
    2040    2043    2046       1    2040    2043    2049       1    2040    2043
    2052       2    2031    2025    2040      34    2025    2040    2043      89
    2010    2007    2019      52    2007    2019    2022      54    2001    2007
    2010      56    2001    2007    2019      57    1998    1995    2001      10
    1995    1992    2022      58    1995    2001    2007      59    1992    1995
    1998      60    1992    1995    2001      61    1992    2022    2019      62
    1986    1992    1995      91    1986    1992    2022      92    1983    1980
    1986      93    1980    1977    2022      66    1980    1986    1992      95
    1977    1971    2031      20    1977    1980    1983      96    1977    1980
    1986      97    1977    2022    2019      71    1977    2022    1992      70
    1971    1977    1980      72    1971    1977    2022      73    1971    2031
    2025      98    1968    1962    2025      34    1968    1971    1977      33
    1968    1971    2031      34    1962    1968    1971      37    1962    2025
    2031      98    1962    2025    2040      34    1953    1962    1968      34
    1953    1962    2025      98    1950    1953    1962      34    1947    1941
    1950       1    1944    1941    1947      49    1944    1941    1950       1
    1941    1950    1953      89    2139    2142    2145       1    2139    2142
    2148       1    2139    2142    2151       2    2130    2124    2139       4
    2124    2139    2142       8    2109    2106    2118      52    2106    2118
    2121      54    2100    2106    2109      56    2100    2106    2118      57
    2097    2094    2100      10    2094    2091    2121      58    2094    2100
    2106      59    2091    2094    2097      60    2091    2094    2100      61
    2091    2121    2118      62    2088    2091    2094      63    2088    2091
    2121      64    2082    2079    2121      66    2082    2088    2091      67
    2079    2073    2130      20    2079    2082    2088      69    2079    2121
    2091      70    2079    2121    2118      71    2073    2079    2082      72
    2073    2079    2121      73    2073    2130    2124      29    2070    2064
    2124      31    2070    2073    2079      33    2070    2073    2130      34
    2064    2070    2073      37    2064    2124    2130      38    2064    2124
    2139       4    2055    2064    2070      42    2055    2064    2124      43
    2052    2055    2064      48    2049    2043    2052       1    2046    2043
    2049      49    2046    2043    2052       1    2043    2052    2055      50
    2238    2241    2244       1    2238    2241    2247       1    2238    2241
    2250       2    2229    2223    2238       4    2223    2238    2241       8
    2208    2205    2217      52    2205    2217    2220      54    2199    2205
    2208      56    2199    2205    2217      57    2196    2193    2199      10
    2193    2190    2220      58    2193    2199    2205      59    2190    2193
    2196      60    2190    2193    2199      61    2190    2220    2217      62
    2187    2190    2193      63    2187    2190    2220      64    2181    2178
    2220      66    2181    2187    2190      67    2178    2172    2229      20
    2178    2181    2187      69    2178    2220    2190      70    2178    2220
    2217      71    2172    2178    2181      72    2172    2178    2220      73
    2172    2229    2223      29    2169    2163    2223      31    2169    2172
    2178      33    2169    2172    2229      34    2163    2169    2172      37
    2163    2223    2229      38    2163    2223    2238       4    2154    2163
    2169      42    2154    2163    2223      43    2151    2154    2163      48
    2148    2142    2151       1    2145    2142    2148      49    2145    2142
    2151       1    2142    2151    2154      50    2325    2319    2334     100
    2307    2313    2316      75    2304    2307    2313      76    2295    2292
    2304      52    2292    2289    2316      77    2292    2304    2307      78
    2289    2292    2295      79    2289    2292    2304      80    2289    2316
    2313      62    2286    2289    2292      81    2286    2289    2316      64
    2280    2277    2316      83    2280    2286    2289      84    2277    2271
    2325      20    2277    2280    2286      86    2277    2316    2289      70
    2277    2316    2313      71    2271    2277    2280      87    2271    2277
    2316      73    2271    2325    2319      29    2268    2262    2319      31
    2268    2271    2277      33    2268    2271    2325      34    2262    2268
    2271      37    2262    2319    2325      38    2262    2319    2334     100
    2253    2262    2268      42    2253    2262    2319      43    2250    2253
    2262      48    2247    2241    2250       1    2244    2241    2247      49
    2244    2241    2250       1    2241    2250    2253      50
%FLAG DIHEDRALS_INC_HYDROGEN                                                    
%FORMAT(10I8)                                                                   
      84      78      72      87       4      84      78     -72      87       5
      81      78      72      87       4      81      78     -72      87       5
      75      72      78      81       9      75      72      78      84       9
      75      72      87      90      10      63      60      66      69      15
      57      54      60      63      15      51      42      39      54       5
      48      42      39      54       5      45      42      39      54       5
      39      54      60      63      15      36      33      30      66      17
      36      33      39      42      18      36      33      39      54      18
      33      39      42      45      20      33      39     -42      45      21
      33      39      42      48      20      33      39     -42      48      21
      33      39      42      51      20      33      39     -42      51      21
      30      24      78      81       9      30      24      78      84       9
      30      66      60      63      15      27      24      30      33      14
      27      24      30      66      14      27      24      78      72       9
      27      24      78      81       9      27      24      78      84       9
      24      30      33      36      17      24      78      72      75       9
      21      15      72      75       4      21      15     -72      75       5
      21      24      78      81       4      21      24     -78      81       5
      21      24      78      84       4      21      24     -78      84       5
      18      15      21      24      10      18      15      72      75       9
      18      15      72      78       9      18      15      72      87       4
      18      15     -72      87       5      15      21      24      27      10
      15      72      78      81      35      15      72      78      84      35
      12       6      15      18       9      12       6      15      21       4
      12       6      15      72       9       9       6      15      18       9
       9       6      15      21       4       9       6      15      72       9
       6      15      72      75       9       3       6      15      18       4
       0       3       6       9      39       0       3       6      12      39
       0       3       6      15      39     180     174     168     183       4
     180     174    -168     183       5     177     174     168     183       4
     177     174    -168     183       5     171     168     174     177       9
     171     168     174     180       9     171     168     183     186      10
     159     156     162     165      15     153     150     156     159      15
     147     138     135     150       5     144     138     135     150       5
     141     138     135     150       5     135     150     156     159      15
     132     129     126     162      17     132     129     135     138      18
     132     129     135     150      18     129     135     138     141      20
     129     135    -138     141      21     129     135     138     144      20
     129     135    -138     144      21     129     135     138     147      20
     129     135    -138     147      21     126     120     174     177       9
     126     120     174     180       9     126     162     156     159      15
     123     120     126     129      14     123     120     126     162      14
     123     120     174     168       9     123     120     174     177       9
     123     120     174     180       9     120     126     129     132      17
     120     174     168     171       9     117     111     168     171       4
     117     111    -168     171       5     117     120     174     177       4
     117     120    -174     177       5     117     120     174     180       4
     117     120    -174     180       5     114     111     117     120      10
     114     111     168     171       9     114     111     168     174       9
     114     111     168     183       4     114     111    -168     183       5
     111     117     120     123      10     111     168     174     177      35
     111     168     174     180      35     108     102     111     114       9
     108     102     111     117       4     108     102     111     168       9
     105     102     111     114       9     105     102     111     117       4
     105     102     111     168       9     102     111     168     171       9
      99     102     111     114       4      90      99     102     105      10
      90      99     102     108      10     279     273     267     282       4
     279     273    -267     282       5     276     273     267     282       4
     276     273    -267     282       5     270     267     273     276       9
     270     267     273     279       9     270     267     282     285      10
     258     252     249     261      45     255     252     249     261      45
     246     243     249     252      47     246     243     249     261      47
     243     249     252     255      45     243     249     252     258      45
     240     237     243     246      15     234     237     243     246      15
     228     225     222     264      51     228     225     231     234      52
     222     216     273     276       9     222     216     273     279       9
     219     216     222     225      14     219     216     222     264      14
     219     216     273     267       9     219     216     273     276       9
     219     216     273     279       9     216     222     225     228      51
     216     273     267     270       9     213     207     267     270       4
     213     207    -267     270       5     213     216     273     276       4
     213     216    -273     276       5     213     216     273     279       4
     213     216    -273     279       5     210     207     213     216      10
     210     207     267     270       9     210     207     267     273       9
     210     207     267     282       4     210     207    -267     282       5
     207     213     216     219      10     207     267     273     276      35
     207     267     273     279      35     204     198     207     210       9
     204     198     207     213       4     204     198     207     267       9
     201     198     207     210       9     201     198     207     213       4
     201     198     207     267       9     198     207     267     270       9
     195     198     207     210       4     186     195     198     201      10
     186     195     198     204      10     378     372     366     381       4
     378     372    -366     381       5     375     372     366     381       4
     375     372    -366     381       5     369     366     372     375       9
     369     366     372     378       9     369     366     381     384      10
     357     351     348     360      45     354     351     348     360      45
     345     342     348     351      47     345     342     348     360      47
     342     348     351     354      45     342     348     351     357      45
     339     336     342     345      15     333     336     342     345      15
     327     324     321     363      51     327     324     330     333      52
     321     315     372     375       9     321     315     372     378       9
     318     315     321     324      14     318     315     321     363      14
     318     315     372     366       9     318     315     372     375       9
     318     315     372     378       9     315     321     324     327      51
     315     372     366     369       9     312     306     366     369       4
     312     306    -366     369       5     312     315     372     375       4
     312     315    -372     375       5     312     315     372     378       4
     312     315    -372     378       5     309     306     312     315      10
     309     306     366     369       9     309     306     366     372       9
     309     306     366     381       4     309     306    -366     381       5
     306     312     315     318      10     306     366     372     375      35
     306     366     372     378      35     303     297     306     309       9
     303     297     306     312       4     303     297     306     366       9
     300     297     306     309       9     300     297     306     312       4
     300     297     306     366       9     297     306     366     369       9
     294     297     306     309       4     285     294     297     300      10
     285     294     297     303      10     477     471     465     480       4
     477     471    -465     480       5     474     471     465     480       4
     474     471    -465     480       5     468     465     471     474       9
     468     465     471     477       9     468     465     480     483      10
     456     450     447     459      45     453     450     447     459      45
     444     441     447     450      47     444     441     447     459      47
     441     447     450     453      45     441     447     450     456      45
     438     435     441     444      15     432     435     441     444      15
     426     423     420     462      51     426     423     429     432      52
     420     414     471     474       9     420     414     471     477       9
     417     414     420     423      14     417     414     420     462      14
     417     414     471     465       9     417     414     471     474       9
     417     414     471     477       9     414     420     423     426      51
     414     471     465     468       9     411     405     465     468       4
     411     405    -465     468       5     411     414     471     474       4
     411     414    -471     474       5     411     414     471     477       4
     411     414    -471     477       5     408     405     411     414      10
     408     405     465     468       9     408     405     465     471       9
     408     405     465     480       4     408     405    -465     480       5
     405     411     414     417      10     405     465     471     474      35
     405     465     471     477      35     402     396     405     408       9
     402     396     405     411       4     402     396     405     465       9
     399     396     405     408       9     399     396     405     411       4
     399     396     405     465       9     396     405     465     468       9
     393     396     405     408       4     384     393     396     399      10
     384     393     396     402      10     573     567     561     576       4
     573     567    -561     576       5     570     567     561     576       4
     570     567    -561     576       5     564     561     567     570       9
     564     561     567     573       9     564     561     576     579      10
     552     549     555     558      15     546     543     549     552      15
     540     531     528     543       5     537     531     528     543       5
     534     531     528     543       5     528     543     549     552      15
     525     522     519     555      17     525     522     528     531      18
     525     522     528     543      18     522     528     531     534      20
     522     528    -531     534      21     522     528     531     537      20
     522     528    -531     537      21     522     528     531     540      20
     522     528    -531     540      21     519     513     567     570       9
     519     513     567     573       9     519     555     549     552      15
     516     513     519     522      14     516     513     519     555      14
     516     513     567     561       9     516     513     567     570       9
     516     513     567     573       9     513     519     522     525      17
     513     567     561     564       9     510     504     561     564       4
     510     504    -561     564       5     510     513     567     570       4
     510     513    -567     570       5     510     513     567     573       4
     510     513    -567     573       5     507     504     510     513      10
     507     504     561     564       9     507     504     561     567       9
     507     504     561     576       4     507     504    -561     576       5
     504     510     513     516      10     504     561     567     570      35
     504     561     567     573      35     501     495     504     507       9
     501     495     504     510       4     501     495     504     561       9
     498     495     504     507       9     498     495     504     510       4
     498     495     504     561       9     495     504     561     564       9
     492     495     504     507       4     483     492     495     498      10
     483     492     495     501      10     669     663     657     672       4
     669     663    -657     672       5     666     663     657     672       4
     666     663    -657     672       5     660     657     663     666       9
     660     657     663     669       9     660     657     672     675      10
     648     645     651     654      15     642     639     645     648      15
     636     627     624     639       5     633     627     624     639       5
     630     627     624     639       5     624     639     645     648      15
     621     618     615     651      17     621     618     624     627      18
     621     618     624     639      18     618     624     627     630      20
     618     624    -627     630      21     618     624     627     633      20
     618     624    -627     633      21     618     624     627     636      20
     618     624    -627     636      21     615     609     663     666       9
     615     609     663     669       9     615     651     645     648      15
     612     609     615     618      14     612     609     615     651      14
     612     609     663     657       9     612     609     663     666       9
     612     609     663     669       9     609     615     618     621      17
     609     663     657     660       9     606     600     657     660       4
     606     600    -657     660       5     606     609     663     666       4
     606     609    -663     666       5     606     609     663     669       4
     606     609    -663     669       5     603     600     606     609      10
     603     600     657     660       9     603     600     657     663       9
     603     600     657     672       4     603     600    -657     672       5
     600     606     609     612      10     600     657     663     666      35
     600     657     663     669      35     597     591     600     603       9
     597     591     600     606       4     597     591     600     657       9
     594     591     600     603       9     594     591     600     606       4
     594     591     600     657       9     591     600     657     660       9
     588     591     600     603       4     579     588     591     594      10
     579     588     591     597      10     765     759     753     768       4
     765     759    -753     768       5     762     759     753     768       4
     762     759    -753     768       5     756     753     759     762       9
     756     753     759     765       9     756     753     768     771      10
     744     741     747     750      58     735     729     726     738      45
     732     729     726     738      45     726     738     741     744      58
     723     726     729     732      45     723     726     729     735      45
     717     714     711     750      51     717     714     720     723      52
     711     705     759     762       9     711     705     759     765       9
     708     705     711     714      14     708     705     711     750      14
     708     705     759     753       9     708     705     759     762       9
     708     705     759     765       9     705     711     714     717      51
     705     759     753     756       9     702     696     753     756       4
     702     696    -753     756       5     702     705     759     762       4
     702     705    -759     762       5     702     705     759     765       4
     702     705    -759     765       5     699     696     702     705      10
     699     696     753     756       9     699     696     753     759       9
     699     696     753     768       4     699     696    -753     768       5
     696     702     705     708      10     696     753     759     762      35
     696     753     759     765      35     693     687     696     699       9
     693     687     696     702       4     693     687     696     753       9
     690     687     696     699       9     690     687     696     702       4
     690     687     696     753       9     687     696     753     756       9
     684     687     696     699       4     675     684     687     690      10
     675     684     687     693      10     864     858     852     867       4
     864     858    -852     867       5     861     858     852     867       4
     861     858    -852     867       5     855     852     858     861       9
     855     852     858     864       9     855     852     867     870      10
     843     837     834     846      45     840     837     834     846      45
     831     828     834     837      47     831     828     834     846      47
     828     834     837     840      45     828     834     837     843      45
     825     822     828     831      15     819     822     828     831      15
     813     810     807     849      51     813     810     816     819      52
     807     801     858     861       9     807     801     858     864       9
     804     801     807     810      14     804     801     807     849      14
     804     801     858     852       9     804     801     858     861       9
     804     801     858     864       9     801     807     810     813      51
     801     858     852     855       9     798     792     852     855       4
     798     792    -852     855       5     798     801     858     861       4
     798     801    -858     861       5     798     801     858     864       4
     798     801    -858     864       5     795     792     798     801      10
     795     792     852     855       9     795     792     852     858       9
     795     792     852     867       4     795     792    -852     867       5
     792     798     801     804      10     792     852     858     861      35
     792     852     858     864      35     789     783     792     795       9
     789     783     792     798       4     789     783     792     852       9
     786     783     792     795       9     786     783     792     798       4
     786     783     792     852       9     783     792     852     855       9
     780     783     792     795       4     771     780     783     786      10
     771     780     783     789      10     963     957     951     966       4
     963     957    -951     966       5     960     957     951     966       4
     960     957    -951     966       5     954     951     957     960       9
     954     951     957     963       9     954     951     966     969      10
     942     936     933     945      45     939     936     933     945      45
     930     927     933     936      47     930     927     933     945      47
     927     933     936     939      45     927     933     936     942      45
     924     921     927     930      15     918     921     927     930      15
     912     909     906     948      51     912     909     915     918      52
     906     900     957     960       9     906     900     957     963       9
     903     900     906     909      14     903     900     906     948      14
     903     900     957     951       9     903     900     957     960       9
     903     900     957     963       9     900     906     909     912      51
     900     957     951     954       9     897     891     951     954       4
     897     891    -951     954       5     897     900     957     960       4
     897     900    -957     960       5     897     900     957     963       4
     897     900    -957     963       5     894     891     897     900      10
     894     891     951     954       9     894     891     951     957       9
     894     891     951     966       4     894     891    -951     966       5
     891     897     900     903      10     891     951     957     960      35
     891     951     957     963      35     888     882     891     894       9
     888     882     891     897       4     888     882     891     951       9
     885     882     891     894       9     885     882     891     897       4
     885     882     891     951       9     882     891     951     954       9
     879     882     891     894       4     870     879     882     885      10
     870     879     882     888      10    1062    1056    1050    1065       4
    1062    1056   -1050    1065       5    1059    1056    1050    1065       4
    1059    1056   -1050    1065       5    1053    1050    1056    1059       9
    1053    1050    1056    1062       9    1053    1050    1065    1068      10
    1041    1035    1032    1044      45    1038    1035    1032    1044      45
    1029    1026    1032    1035      47    1029    1026    1032    1044      47
    1026    1032    1035    1038      45    1026    1032    1035    1041      45
    1023    1020    1026    1029      15    1017    1020    1026    1029      15
    1011    1008    1005    1047      51    1011    1008    1014    1017      52
    1005     999    1056    1059       9    1005     999    1056    1062       9
    1002     999    1005    1008      14    1002     999    1005    1047      14
    1002     999    1056    1050       9    1002     999    1056    1059       9
    1002     999    1056    1062       9     999    1005    1008    1011      51
     999    1056    1050    1053       9     996     990    1050    1053       4
     996     990   -1050    1053       5     996     999    1056    1059       4
     996     999   -1056    1059       5     996     999    1056    1062       4
     996     999   -1056    1062       5     993     990     996     999      10
     993     990    1050    1053       9     993     990    1050    1056       9
     993     990    1050    1065       4     993     990   -1050    1065       5
     990     996     999    1002      10     990    1050    1056    1059      35
     990    1050    1056    1062      35     987     981     990     993       9
     987     981     990     996       4     987     981     990    1050       9
     984     981     990     993       9     984     981     990     996       4
     984     981     990    1050       9     981     990    1050    1053       9
     978     981     990     993       4     969     978     981     984      10
     969     978     981     987      10    1158    1152    1146    1161       4
    1158    1152   -1146    1161       5    1155    1152    1146    1161       4
    1155    1152   -1146    1161       5    1149    1146    1152    1155       9
    1149    1146    1152    1158       9    1149    1146    1161    1164      10
    1137    1134    1140    1143      15    1131    1128    1134    1137      15
    1125    1116    1113    1128       5    1122    1116    1113    1128       5
    1119    1116    1113    1128       5    1113    1128    1134    1137      15
    1110    1107    1104    1140      17    1110    1107    1113    1116      18
    1110    1107    1113    1128      18    1107    1113    1116    1119      20
    1107    1113   -1116    1119      21    1107    1113    1116    1122      20
    1107    1113   -1116    1122      21    1107    1113    1116    1125      20
    1107    1113   -1116    1125      21    1104    1098    1152    1155       9
    1104    1098    1152    1158       9    1104    1140    1134    1137      15
    1101    1098    1104    1107      14    1101    1098    1104    1140      14
    1101    1098    1152    1146       9    1101    1098    1152    1155       9
    1101    1098    1152    1158       9    1098    1104    1107    1110      17
    1098    1152    1146    1149       9    1095    1089    1146    1149       4
    1095    1089   -1146    1149       5    1095    1098    1152    1155       4
    1095    1098   -1152    1155       5    1095    1098    1152    1158       4
    1095    1098   -1152    1158       5    1092    1089    1095    1098      10
    1092    1089    1146    1149       9    1092    1089    1146    1152       9
    1092    1089    1146    1161       4    1092    1089   -1146    1161       5
    1089    1095    1098    1101      10    1089    1146    1152    1155      35
    1089    1146    1152    1158      35    1086    1080    1089    1092       9
    1086    1080    1089    1095       4    1086    1080    1089    1146       9
    1083    1080    1089    1092       9    1083    1080    1089    1095       4
    1083    1080    1089    1146       9    1080    1089    1146    1149       9
    1077    1080    1089    1092       4    1068    1077    1080    1083      10
    1068    1077    1080    1086      10    1254    1248    1242    1257       4
    1254    1248   -1242    1257       5    1251    1248    1242    1257       4
    1251    1248   -1242    1257       5    1245    1242    1248    1251       9
    1245    1242    1248    1254       9    1245    1242    1257    1260      10
    1233    1230    1236    1239      15    1227    1224    1230    1233      15
    1221    1212    1209    1224       5    1218    1212    1209    1224       5
    1215    1212    1209    1224       5    1209    1224    1230    1233      15
    1206    1203    1200    1236      17    1206    1203    1209    1212      18
    1206    1203    1209    1224      18    1203    1209    1212    1215      20
    1203    1209   -1212    1215      21    1203    1209    1212    1218      20
    1203    1209   -1212    1218      21    1203    1209    1212    1221      20
    1203    1209   -1212    1221      21    1200    1194    1248    1251       9
    1200    1194    1248    1254       9    1200    1236    1230    1233      15
    1197    1194    1200    1203      14    1197    1194    1200    1236      14
    1197    1194    1248    1242       9    1197    1194    1248    1251       9
    1197    1194    1248    1254       9    1194    1200    1203    1206      17
    1194    1248    1242    1245       9    1191    1185    1242    1245       4
    1191    1185   -1242    1245       5    1191    1194    1248    1251       4
    1191    1194   -1248    1251       5    1191    1194    1248    1254       4
    1191    1194   -1248    1254       5    1188    1185    1191    1194      10
    1188    1185    1242    1245       9    1188    1185    1242    1248       9
    1188    1185    1242    1257       4    1188    1185   -1242    1257       5
    1185    1191    1194    1197      10    1185    1242    1248    1251      35
    1185    1242    1248    1254      35    1182    1176    1185    1188       9
    1182    1176    1185    1191       4    1182    1176    1185    1242       9
    1179    1176    1185    1188       9    1179    1176    1185    1191       4
    1179    1176    1185    1242       9    1176    1185    1242    1245       9
    1173    1176    1185    1188       4    1164    1173    1176    1179      10
    1164    1173    1176    1182      10    1350    1344    1338    1353       4
    1350    1344   -1338    1353       5    1347    1344    1338    1353       4
    1347    1344   -1338    1353       5    1341    1338    1344    1347       9
    1341    1338    1344    1350       9    1341    1338    1353    1356      10
    1329    1326    1332    1335      58    1320    1314    1311    1323      45
    1317    1314    1311    1323      45    1311    1323    1326    1329      58
    1308    1311    1314    1317      45    1308    1311    1314    1320      45
    1302    1299    1296    1335      51    1302    1299    1305    1308      52
    1296    1290    1344    1347       9    1296    1290    1344    1350       9
    1293    1290    1296    1299      14    1293    1290    1296    1335      14
    1293    1290    1344    1338       9    1293    1290    1344    1347       9
    1293    1290    1344    1350       9    1290    1296    1299    1302      51
    1290    1344    1338    1341       9    1287    1281    1338    1341       4
    1287    1281   -1338    1341       5    1287    1290    1344    1347       4
    1287    1290   -1344    1347       5    1287    1290    1344    1350       4
    1287    1290   -1344    1350       5    1284    1281    1287    1290      10
    1284    1281    1338    1341       9    1284    1281    1338    1344       9
    1284    1281    1338    1353       4    1284    1281   -1338    1353       5
    1281    1287    1290    1293      10    1281    1338    1344    1347      35
    1281    1338    1344    1350      35    1278    1272    1281    1284       9
    1278    1272    1281    1287       4    1278    1272    1281    1338       9
    1275    1272    1281    1284       9    1275    1272    1281    1287       4
    1275    1272    1281    1338       9    1272    1281    1338    1341       9
    1269    1272    1281    1284       4    1260    1269    1272    1275      10
    1260    1269    1272    1278      10    1449    1443    1437    1452       4
    1449    1443   -1437    1452       5    1446    1443    1437    1452       4
    1446    1443   -1437    1452       5    1440    1437    1443    1446       9
    1440    1437    1443    1449       9    1440    1437    1452    1455      10
    1428    1422    1419    1431      45    1425    1422    1419    1431      45
    1416    1413    1419    1422      47    1416    1413    1419    1431      47
    1413    1419    1422    1425      45    1413    1419    1422    1428      45
    1410    1407    1413    1416      15    1404    1407    1413    1416      15
    1398    1395    1392    1434      51    1398    1395    1401    1404      52
    1392    1386    1443    1446       9    1392    1386    1443    1449       9
    1389    1386    1392    1395      14    1389    1386    1392    1434      14
    1389    1386    1443    1437       9    1389    1386    1443    1446       9
    1389    1386    1443    1449       9    1386    1392    1395    1398      51
    1386    1443    1437    1440       9    1383    1377    1437    1440       4
    1383    1377   -1437    1440       5    1383    1386    1443    1446       4
    1383    1386   -1443    1446       5    1383    1386    1443    1449       4
    1383    1386   -1443    1449       5    1380    1377    1383    1386      10
    1380    1377    1437    1440       9    1380    1377    1437    1443       9
    1380    1377    1437    1452       4    1380    1377   -1437    1452       5
    1377    1383    1386    1389      10    1377    1437    1443    1446      35
    1377    1437    1443    1449      35    1374    1368    1377    1380       9
    1374    1368    1377    1383       4    1374    1368    1377    1437       9
    1371    1368    1377    1380       9    1371    1368    1377    1383       4
    1371    1368    1377    1437       9    1368    1377    1437    1440       9
    1365    1368    1377    1380       4    1356    1365    1368    1371      10
    1356    1365    1368    1374      10    1548    1542    1536    1551       4
    1548    1542   -1536    1551       5    1545    1542    1536    1551       4
    1545    1542   -1536    1551       5    1539    1536    1542    1545       9
    1539    1536    1542    1548       9    1539    1536    1551    1554      10
    1527    1521    1518    1530      45    1524    1521    1518    1530      45
    1515    1512    1518    1521      47    1515    1512    1518    1530      47
    1512    1518    1521    1524      45    1512    1518    1521    1527      45
    1509    1506    1512    1515      15    1503    1506    1512    1515      15
    1497    1494    1491    1533      51    1497    1494    1500    1503      52
    1491    1485    1542    1545       9    1491    1485    1542    1548       9
    1488    1485    1491    1494      14    1488    1485    1491    1533      14
    1488    1485    1542    1536       9    1488    1485    1542    1545       9
    1488    1485    1542    1548       9    1485    1491    1494    1497      51
    1485    1542    1536    1539       9    1482    1476    1536    1539       4
    1482    1476   -1536    1539       5    1482    1485    1542    1545       4
    1482    1485   -1542    1545       5    1482    1485    1542    1548       4
    1482    1485   -1542    1548       5    1479    1476    1482    1485      10
    1479    1476    1536    1539       9    1479    1476    1536    1542       9
    1479    1476    1536    1551       4    1479    1476   -1536    1551       5
    1476    1482    1485    1488      10    1476    1536    1542    1545      35
    1476    1536    1542    1548      35    1473    1467    1476    1479       9
    1473    1467    1476    1482       4    1473    1467    1476    1536       9
    1470    1467    1476    1479       9    1470    1467    1476    1482       4
    1470    1467    1476    1536       9    1467    1476    1536    1539       9
    1464    1467    1476    1479       4    1455    1464    1467    1470      10
    1455    1464    1467    1473      10    1647    1641    1635    1650       4
    1647    1641   -1635    1650       5    1644    1641    1635    1650       4
    1644    1641   -1635    1650       5    1638    1635    1641    1644       9
    1638    1635    1641    1647       9    1638    1635    1650    1653      10
    1626    1620    1617    1629      45    1623    1620    1617    1629      45
    1614    1611    1617    1620      47    1614    1611    1617    1629      47
    1611    1617    1620    1623      45    1611    1617    1620    1626      45
    1608    1605    1611    1614      15    1602    1605    1611    1614      15
    1596    1593    1590    1632      51    1596    1593    1599    1602      52
    1590    1584    1641    1644       9    1590    1584    1641    1647       9
    1587    1584    1590    1593      14    1587    1584    1590    1632      14
    1587    1584    1641    1635       9    1587    1584    1641    1644       9
    1587    1584    1641    1647       9    1584    1590    1593    1596      51
    1584    1641    1635    1638       9    1581    1575    1635    1638       4
    1581    1575   -1635    1638       5    1581    1584    1641    1644       4
    1581    1584   -1641    1644       5    1581    1584    1641    1647       4
    1581    1584   -1641    1647       5    1578    1575    1581    1584      10
    1578    1575    1635    1638       9    1578    1575    1635    1641       9
    1578    1575    1635    1650       4    1578    1575   -1635    1650       5
    1575    1581    1584    1587      10    1575    1635    1641    1644      35
    1575    1635    1641    1647      35    1572    1566    1575    1578       9
    1572    1566    1575    1581       4    1572    1566    1575    1635       9
    1569    1566    1575    1578       9    1569    1566    1575    1581       4
    1569    1566    1575    1635       9    1566    1575    1635    1638       9
    1563    1566    1575    1578       4    1554    1563    1566    1569      10
    1554    1563    1566    1572      10    1743    1737    1731    1746       4
    1743    1737   -1731    1746       5    1740    1737    1731    1746       4
    1740    1737   -1731    1746       5    1734    1731    1737    1740       9
    1734    1731    1737    1743       9    1734    1731    1746    1749      10
    1722    1719    1725    1728      15    1716    1713    1719    1722      15
    1710    1701    1698    1713       5    1707    1701    1698    1713       5
    1704    1701    1698    1713       5    1698    1713    1719    1722      15
    1695    1692    1689    1725      17    1695    1692    1698    1701      18
    1695    1692    1698    1713      18    1692    1698    1701    1704      20
    1692    1698   -1701    1704      21    1692    1698    1701    1707      20
    1692    1698   -1701    1707      21    1692    1698    1701    1710      20
    1692    1698   -1701    1710      21    1689    1683    1737    1740       9
    1689    1683    1737    1743       9    1689    1725    1719    1722      15
    1686    1683    1689    1692      14    1686    1683    1689    1725      14
    1686    1683    1737    1731       9    1686    1683    1737    1740       9
    1686    1683    1737    1743       9    1683    1689    1692    1695      17
    1683    1737    1731    1734       9    1680    1674    1731    1734       4
    1680    1674   -1731    1734       5    1680    1683    1737    1740       4
    1680    1683   -1737    1740       5    1680    1683    1737    1743       4
    1680    1683   -1737    1743       5    1677    1674    1680    1683      10
    1677    1674    1731    1734       9    1677    1674    1731    1737       9
    1677    1674    1731    1746       4    1677    1674   -1731    1746       5
    1674    1680    1683    1686      10    1674    1731    1737    1740      35
    1674    1731    1737    1743      35    1671    1665    1674    1677       9
    1671    1665    1674    1680       4    1671    1665    1674    1731       9
    1668    1665    1674    1677       9    1668    1665    1674    1680       4
    1668    1665    1674    1731       9    1665    1674    1731    1734       9
    1662    1665    1674    1677       4    1653    1662    1665    1668      10
    1653    1662    1665    1671      10    1839    1833    1827    1842       4
    1839    1833   -1827    1842       5    1836    1833    1827    1842       4
    1836    1833   -1827    1842       5    1830    1827    1833    1836       9
    1830    1827    1833    1839       9    1830    1827    1842    1845      10
    1818    1815    1821    1824      15    1812    1809    1815    1818      15
    1806    1797    1794    1809       5    1803    1797    1794    1809       5
    1800    1797    1794    1809       5    1794    1809    1815    1818      15
    1791    1788    1785    1821      17    1791    1788    1794    1797      18
    1791    1788    1794    1809      18    1788    1794    1797    1800      20
    1788    1794   -1797    1800      21    1788    1794    1797    1803      20
    1788    1794   -1797    1803      21    1788    1794    1797    1806      20
    1788    1794   -1797    1806      21    1785    1779    1833    1836       9
    1785    1779    1833    1839       9    1785    1821    1815    1818      15
    1782    1779    1785    1788      14    1782    1779    1785    1821      14
    1782    1779    1833    1827       9    1782    1779    1833    1836       9
    1782    1779    1833    1839       9    1779    1785    1788    1791      17
    1779    1833    1827    1830       9    1776    1770    1827    1830       4
    1776    1770   -1827    1830       5    1776    1779    1833    1836       4
    1776    1779   -1833    1836       5    1776    1779    1833    1839       4
    1776    1779   -1833    1839       5    1773    1770    1776    1779      10
    1773    1770    1827    1830       9    1773    1770    1827    1833       9
    1773    1770    1827    1842       4    1773    1770   -1827    1842       5
    1770    1776    1779    1782      10    1770    1827    1833    1836      35
    1770    1827    1833    1839      35    1767    1761    1770    1773       9
    1767    1761    1770    1776       4    1767    1761    1770    1827       9
    1764    1761    1770    1773       9    1764    1761    1770    1776       4
    1764    1761    1770    1827       9    1761    1770    1827    1830       9
    1758    1761    1770    1773       4    1749    1758    1761    1764      10
    1749    1758    1761    1767      10    1935    1929    1923    1938       4
    1935    1929   -1923    1938       5    1932    1929    1923    1938       4
    1932    1929   -1923    1938       5    1926    1923    1929    1932       9
    1926    1923    1929    1935       9    1926    1923    1938    1941      10
    1914    1911    1917    1920      58    1905    1899    1896    1908      45
    1902    1899    1896    1908      45    1896    1908    1911    1914      58
    1893    1896    1899    1902      45    1893    1896    1899    1905      45
    1887    1884    1881    1920      51    1887    1884    1890    1893      52
    1881    1875    1929    1932       9    1881    1875    1929    1935       9
    1878    1875    1881    1884      14    1878    1875    1881    1920      14
    1878    1875    1929    1923       9    1878    1875    1929    1932       9
    1878    1875    1929    1935       9    1875    1881    1884    1887      51
    1875    1929    1923    1926       9    1872    1866    1923    1926       4
    1872    1866   -1923    1926       5    1872    1875    1929    1932       4
    1872    1875   -1929    1932       5    1872    1875    1929    1935       4
    1872    1875   -1929    1935       5    1869    1866    1872    1875      10
    1869    1866    1923    1926       9    1869    1866    1923    1929       9
    1869    1866    1923    1938       4    1869    1866   -1923    1938       5
    1866    1872    1875    1878      10    1866    1923    1929    1932      35
    1866    1923    1929    1935      35    1863    1857    1866    1869       9
    1863    1857    1866    1872       4    1863    1857    1866    1923       9
    1860    1857    1866    1869       9    1860    1857    1866    1872       4
    1860    1857    1866    1923       9    1857    1866    1923    1926       9
    1854    1857    1866    1869       4    1845    1854    1857    1860      10
    1845    1854    1857    1863      10    2037    2031    2025    2040       4
    2037    2031   -2025    2040       5    2034    2031    2025    2040       4
    2034    2031   -2025    2040       5    2028    2025    2031    2034       9
    2028    2025    2031    2037       9    2028    2025    2040    2043      10
    2016    2010    2007    2019      45    2013    2010    2007    2019      45
    2004    2001    2007    2010      47    2004    2001    2007    2019      47
    2001    2007    2010    2013      45    2001    2007    2010    2016      45
    1998    1995    2001    2004      15    1992    1995    2001    2004      15
    1989    1986    1992    1995      47    1989    1986    1992    2022      47
    1983    1980    1986    1989      64    1977    1971    2031    2034       9
    1977    1971    2031    2037       9    1977    1980    1986    1989      64
    1974    1971    1977    1980      14    1974    1971    1977    2022      14
    1974    1971    2031    2025       9    1974    1971    2031    2034       9
    1974    1971    2031    2037       9    1971    2031    2025    2028       9
    1968    1962    2025    2028       4    1968    1962   -2025    2028       5
    1968    1971    2031    2034       4    1968    1971   -2031    2034       5
    1968    1971    2031    2037       4    1968    1971   -2031    2037       5
    1965    1962    1968    1971      10    1965    1962    2025    2028       9
    1965    1962    2025    2031       9    1965    1962    2025    2040       4
    1965    1962   -2025    2040       5    1962    1968    1971    1974      10
    1962    2025    2031    2034      35    1962    2025    2031    2037      35
    1959    1953    1962    1965       9    1959    1953    1962    1968       4
    1959    1953   -1962    1968       5    1959    1953    1962    2025       9
    1956    1953    1962    1965       9    1956    1953    1962    1968       4
    1956    1953   -1962    1968       5    1956    1953    1962    2025       9
    1953    1962    2025    2028       9    1950    1953    1962    1965       4
    1950    1953   -1962    1965       5    1941    1950    1953    1956      10
    1941    1950    1953    1959      10    2136    2130    2124    2139       4
    2136    2130   -2124    2139       5    2133    2130    2124    2139       4
    2133    2130   -2124    2139       5    2127    2124    2130    2133       9
    2127    2124    2130    2136       9    2127    2124    2139    2142      10
    2115    2109    2106    2118      45    2112    2109    2106    2118      45
    2103    2100    2106    2109      47    2103    2100    2106    2118      47
    2100    2106    2109    2112      45    2100    2106    2109    2115      45
    2097    2094    2100    2103      15    2091    2094    2100    2103      15
    2085    2082    2079    2121      51    2085    2082    2088    2091      52
    2079    2073    2130    2133       9    2079    2073    2130    2136       9
    2076    2073    2079    2082      14    2076    2073    2079    2121      14
    2076    2073    2130    2124       9    2076    2073    2130    2133       9
    2076    2073    2130    2136       9    2073    2079    2082    2085      51
    2073    2130    2124    2127       9    2070    2064    2124    2127       4
    2070    2064   -2124    2127       5    2070    2073    2130    2133       4
    2070    2073   -2130    2133       5    2070    2073    2130    2136       4
    2070    2073   -2130    2136       5    2067    2064    2070    2073      10
    2067    2064    2124    2127       9    2067    2064    2124    2130       9
    2067    2064    2124    2139       4    2067    2064   -2124    2139       5
    2064    2070    2073    2076      10    2064    2124    2130    2133      35
    2064    2124    2130    2136      35    2061    2055    2064    2067       9
    2061    2055    2064    2070       4    2061    2055    2064    2124       9
    2058    2055    2064    2067       9    2058    2055    2064    2070       4
    2058    2055    2064    2124       9    2055    2064    2124    2127       9
    2052    2055    2064    2067       4    2043    2052    2055    2058      10
    2043    2052    2055    2061      10    2235    2229    2223    2238       4
    2235    2229   -2223    2238       5    2232    2229    2223    2238       4
    2232    2229   -2223    2238       5    2226    2223    2229    2232       9
    2226    2223    2229    2235       9    2226    2223    2238    2241      10
    2214    2208    2205    2217      45    2211    2208    2205    2217      45
    2202    2199    2205    2208      47    2202    2199    2205    2217      47
    2199    2205    2208    2211      45    2199    2205    2208    2214      45
    2196    2193    2199    2202      15    2190    2193    2199    2202      15
    2184    2181    2178    2220      51    2184    2181    2187    2190      52
    2178    2172    2229    2232       9    2178    2172    2229    2235       9
    2175    2172    2178    2181      14    2175    2172    2178    2220      14
    2175    2172    2229    2223       9    2175    2172    2229    2232       9
    2175    2172    2229    2235       9    2172    2178    2181    2184      51
    2172    2229    2223    2226       9    2169    2163    2223    2226       4
    2169    2163   -2223    2226       5    2169    2172    2229    2232       4
    2169    2172   -2229    2232       5    2169    2172    2229    2235       4
    2169    2172   -2229    2235       5    2166    2163    2169    2172      10
    2166    2163    2223    2226       9    2166    2163    2223    2229       9
    2166    2163    2223    2238       4    2166    2163   -2223    2238       5
    2163    2169    2172    2175      10    2163    2223    2229    2232      35
    2163    2223    2229    2235      35    2160    2154    2163    2166       9
    2160    2154    2163    2169       4    2160    2154    2163    2223       9
    2157    2154    2163    2166       9    2157    2154    2163    2169       4
    2157    2154    2163    2223       9    2154    2163    2223    2226       9
    2151    2154    2163    2166       4    2142    2151    2154    2157      10
    2142    2151    2154    2160      10    2331    2325    2319    2334       4
    2331    2325   -2319    2334       5    2328    2325    2319    2334       4
    2328    2325   -2319    2334       5    2325    2319    2334    2337       4
    2325    2319   -2334    2337      35    2322    2319    2325    2328       9
    2322    2319    2325    2331       9    2322    2319    2334    2337      39
    2310    2307    2313    2316      58    2301    2295    2292    2304      45
    2298    2295    2292    2304      45    2292    2304    2307    2310      58
    2289    2292    2295    2298      45    2289    2292    2295    2301      45
    2283    2280    2277    2316      51    2283    2280    2286    2289      52
    2277    2271    2325    2328       9    2277    2271    2325    2331       9
    2274    2271    2277    2280      14    2274    2271    2277    2316      14
    2274    2271    2325    2319       9    2274    2271    2325    2328       9
    2274    2271    2325    2331       9    2271    2277    2280    2283      51
    2271    2325    2319    2322       9    2268    2262    2319    2322       4
    2268    2262   -2319    2322       5    2268    2271    2325    2328       4
    2268    2271   -2325    2328       5    2268    2271    2325    2331       4
    2268    2271   -2325    2331       5    2265    2262    2268    2271      10
    2265    2262    2319    2322       9    2265    2262    2319    2325       9
    2265    2262    2319    2334       4    2265    2262   -2319    2334       5
    2262    2268    2271    2274      10    2262    2319    2325    2328      35
    2262    2319    2325    2331      35    2262    2319    2334    2337       4
    2262    2319   -2334    2337      35    2259    2253    2262    2265       9
    2259    2253    2262    2268       4    2259    2253    2262    2319       9
    2256    2253    2262    2265       9    2256    2253    2262    2268       4
    2256    2253    2262    2319       9    2253    2262    2319    2322       9
    2250    2253    2262    2265       4    2241    2250    2253    2256      10
    2241    2250    2253    2259      10      54      66     -60     -63      66
      30      39     -33     -36      67     150     162    -156    -159      66
     126     135    -129    -132      67     249     255    -252    -258      66
     237     249    -243    -246      66     231     222    -225    -228      67
     348     354    -351    -357      66     336     348    -342    -345      66
     327     321    -324    -330      67     447     453    -450    -456      66
     435     447    -441    -444      66     426     420    -423    -429      67
     543     555    -549    -552      66     519     528    -522    -525      67
     639     651    -645    -648      66     615     624    -618    -621      67
     738     747    -741    -744      67     726     732    -729    -735      66
     711     720    -714    -717      67     834     840    -837    -843      66
     822     834    -828    -831      66     813     807    -810    -816      67
     933     939    -936    -942      66     921     933    -927    -930      66
     912     906    -909    -915      67    1032    1038   -1035   -1041      66
    1020    1032   -1026   -1029      66    1011    1005   -1008   -1014      67
    1128    1140   -1134   -1137      66    1104    1113   -1107   -1110      67
    1224    1236   -1230   -1233      66    1200    1209   -1203   -1206      67
    1323    1332   -1326   -1329      67    1311    1317   -1314   -1320      66
    1296    1305   -1299   -1302      67    1419    1425   -1422   -1428      66
    1407    1419   -1413   -1416      66    1398    1392   -1395   -1401      67
    1518    1524   -1521   -1527      66    1506    1518   -1512   -1515      66
    1497    1491   -1494   -1500      67    1617    1623   -1620   -1626      66
    1605    1617   -1611   -1614      66    1596    1590   -1593   -1599      67
    1713    1725   -1719   -1722      66    1689    1698   -1692   -1695      67
    1809    1821   -1815   -1818      66    1785    1794   -1788   -1791      67
    1908    1917   -1911   -1914      67    1896    1902   -1899   -1905      66
    1881    1890   -1884   -1887      67    2007    2013   -2010   -2016      66
    1995    2007   -2001   -2004      66    1980    1992   -1986   -1989      66
    2106    2112   -2109   -2115      66    2094    2106   -2100   -2103      66
    2085    2079   -2082   -2088      67    2205    2211   -2208   -2214      66
    2193    2205   -2199   -2202      66    2184    2178   -2181   -2187      67
    2304    2313   -2307   -2310      67    2292    2298   -2295   -2301      66
    2277    2286   -2280   -2283      67
%FLAG DIHEDRALS_WITHOUT_HYDROGEN                                                
%FORMAT(10I8)                                                                   
      87      90      99     102       1      87      90     -99     102       2
      87      90     -99     102       3      78      72      87      90       6
      78      72     -87      90       7      78      72     -87      90       8
      72      87      90      93      11      72      87      90      96      11
      72      87      90      99      12      72      87     -90      99      13
      72      87     -90      99      11      66      30      24      78      14
      57      54      60      66      15      54      60      66      69      15
      42      39      54      57      16      42      39      54      60      16
      39      33      30      66      17      39      54     -60      66      15
      33      30      24      78      14      33      30      66      60      19
      33      30      66      69      19      33      39      54      57      16
      33      39     -54      57      22      33      39     -54      60      16
      30      24      78      72       9      30      33      39      42      18
      30      33      39      54      18      30      66     -60      54      15
      24      21     -15      72      23      24      21     -15      72      24
      24      30      33      39      17      24      30      66      60      19
      24      30      66      69      19      24      78      72      87       9
      21      15     -72      78       9      21      15      72      87      25
      21      15     -72      87      26      21      24      30      33      27
      21      24     -30      33      28      21      24     -30      33      29
      21      24     -30      33      30      21      24      30      66      14
      21      24     -78      72       9      15      21      24      30      31
      15      21     -24      30      24      15      21     -24      78      23
      15      21     -24      78      24      15      72     -78      24      32
      15      72     -78      24      33      15      72     -78      24      34
      15      72      87      90       6      15      72     -87      90       7
      15      72     -87      90       8       6      15      21      24      23
       6      15     -21      24      24       6      15      72      78      32
       6      15     -72      78      33       6      15     -72      78      34
       6      15      72      87       9       3       6      15      21       9
       3       6      15      72      36       3       6     -15      72      37
       3       6     -15      72      38     183     186     195     198       1
     183     186    -195     198       2     183     186    -195     198       3
     174     168     183     186       6     174     168    -183     186       7
     174     168    -183     186       8     168     183     186     189      11
     168     183     186     192      11     168     183     186     195      12
     168     183    -186     195      13     168     183    -186     195      11
     162     126     120     174      14     153     150     156     162      15
     150     156     162     165      15     138     135     150     153      16
     138     135     150     156      16     135     129     126     162      17
     135     150    -156     162      15     129     126     120     174      14
     129     126     162     156      19     129     126     162     165      19
     129     135     150     153      16     129     135    -150     153      22
     129     135    -150     156      16     126     120     174     168       9
     126     129     135     138      18     126     129     135     150      18
     126     162    -156     150      15     120     117    -111     168      23
     120     117    -111     168      24     120     126     129     135      17
     120     126     162     156      19     120     126     162     165      19
     120     174     168     183       9     117     111    -168     174       9
     117     111     168     183      25     117     111    -168     183      26
     117     120     126     129      27     117     120    -126     129      28
     117     120    -126     129      29     117     120    -126     129      30
     117     120     126     162      14     117     120    -174     168       9
     111     117     120     126      31     111     117    -120     126      24
     111     117    -120     174      23     111     117    -120     174      24
     111     168    -174     120      32     111     168    -174     120      33
     111     168    -174     120      34     111     168     183     186       6
     111     168    -183     186       7     111     168    -183     186       8
     102     111     117     120      23     102     111    -117     120      24
     102     111     168     174      32     102     111    -168     174      33
     102     111    -168     174      34     102     111     168     183       9
      99     102     111     117       9      99     102     111     168      36
      99     102    -111     168      37      99     102    -111     168      38
      96      90      99     102      40      93      90      99     102      40
      90      99     102     111      41      90      99    -102     111      42
      90      99    -102     111      43      90      99    -102     111      44
     282     285     294     297       1     282     285    -294     297       2
     282     285    -294     297       3     273     267     282     285       6
     273     267    -282     285       7     273     267    -282     285       8
     267     282     285     288      11     267     282     285     291      11
     267     282     285     294      12     267     282    -285     294      13
     267     282    -285     294      11     264     222     216     273      14
     252     249     261     264      46     243     237     234     264      48
     243     249    -261     264      46     240     237     234     264      48
     240     237     243     249      15     237     234     264     261      49
     237     243     249     252      47     237     243    -249     261      47
     234     237     243     249      15     234     264    -261     249      50
     231     225    -222     264      51     231     234     237     240      48
     231     234     237     243      48     231     234     264     261      49
     225     222     216     273      14     225     222    -264     234      53
     225     222     264     261      53     225     231     234     237      54
     225     231    -234     264      54     222     216     273     267       9
     222     225    -231     234      52     222     264    -234     231      49
     222     264     234     237      49     222     264     261     249      50
     216     213    -207     267      23     216     213    -207     267      24
     216     222     225     231      51     216     222     264     234      53
     216     222     264     261      53     216     273     267     282       9
     213     207    -267     273       9     213     207     267     282      25
     213     207    -267     282      26     213     216     222     225      55
     213     216    -222     225      56     213     216    -222     225      57
     213     216     222     264      14     213     216    -273     267       9
     207     213     216     222      31     207     213    -216     222      24
     207     213    -216     273      23     207     213    -216     273      24
     207     267    -273     216      32     207     267    -273     216      33
     207     267    -273     216      34     207     267     282     285       6
     207     267    -282     285       7     207     267    -282     285       8
     198     207     213     216      23     198     207    -213     216      24
     198     207     267     273      32     198     207    -267     273      33
     198     207    -267     273      34     198     207     267     282       9
     195     198     207     213       9     195     198     207     267      36
     195     198    -207     267      37     195     198    -207     267      38
     192     186     195     198      40     189     186     195     198      40
     186     195     198     207      41     186     195    -198     207      42
     186     195    -198     207      43     186     195    -198     207      44
     381     384     393     396       1     381     384    -393     396       2
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     372     366    -381     384       7     372     366    -381     384       8
     366     381     384     387      11     366     381     384     390      11
     366     381     384     393      12     366     381    -384     393      13
     366     381    -384     393      11     363     321     315     372      14
     351     348     360     363      46     342     336     333     363      48
     342     348    -360     363      46     339     336     333     363      48
     339     336     342     348      15     336     333     363     360      49
     336     342     348     351      47     336     342    -348     360      47
     333     336     342     348      15     333     363    -360     348      50
     330     324    -321     363      51     330     333     336     339      48
     330     333     336     342      48     330     333     363     360      49
     324     321     315     372      14     324     321    -363     333      53
     324     321     363     360      53     324     330     333     336      54
     324     330    -333     363      54     321     315     372     366       9
     321     324    -330     333      52     321     363    -333     330      49
     321     363     333     336      49     321     363     360     348      50
     315     312    -306     366      23     315     312    -306     366      24
     315     321     324     330      51     315     321     363     333      53
     315     321     363     360      53     315     372     366     381       9
     312     306    -366     372       9     312     306     366     381      25
     312     306    -366     381      26     312     315     321     324      55
     312     315    -321     324      56     312     315    -321     324      57
     312     315     321     363      14     312     315    -372     366       9
     306     312     315     321      31     306     312    -315     321      24
     306     312    -315     372      23     306     312    -315     372      24
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     306     366    -372     315      34     306     366     381     384       6
     306     366    -381     384       7     306     366    -381     384       8
     297     306     312     315      23     297     306    -312     315      24
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     297     306    -366     372      34     297     306     366     381       9
     294     297     306     312       9     294     297     306     366      36
     294     297    -306     366      37     294     297    -306     366      38
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     285     294     297     306      41     285     294    -297     306      42
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     480     483     492     495       1     480     483    -492     495       2
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     471     465    -480     483       7     471     465    -480     483       8
     465     480     483     486      11     465     480     483     489      11
     465     480     483     492      12     465     480    -483     492      13
     465     480    -483     492      11     462     420     414     471      14
     450     447     459     462      46     441     435     432     462      48
     441     447    -459     462      46     438     435     432     462      48
     438     435     441     447      15     435     432     462     459      49
     435     441     447     450      47     435     441    -447     459      47
     432     435     441     447      15     432     462    -459     447      50
     429     423    -420     462      51     429     432     435     438      48
     429     432     435     441      48     429     432     462     459      49
     423     420     414     471      14     423     420    -462     432      53
     423     420     462     459      53     423     429     432     435      54
     423     429    -432     462      54     420     414     471     465       9
     420     423    -429     432      52     420     462    -432     429      49
     420     462     432     435      49     420     462     459     447      50
     414     411    -405     465      23     414     411    -405     465      24
     414     420     423     429      51     414     420     462     432      53
     414     420     462     459      53     414     471     465     480       9
     411     405    -465     471       9     411     405     465     480      25
     411     405    -465     480      26     411     414     420     423      55
     411     414    -420     423      56     411     414    -420     423      57
     411     414     420     462      14     411     414    -471     465       9
     405     411     414     420      31     405     411    -414     420      24
     405     411    -414     471      23     405     411    -414     471      24
     405     465    -471     414      32     405     465    -471     414      33
     405     465    -471     414      34     405     465     480     483       6
     405     465    -480     483       7     405     465    -480     483       8
     396     405     411     414      23     396     405    -411     414      24
     396     405     465     471      32     396     405    -465     471      33
     396     405    -465     471      34     396     405     465     480       9
     393     396     405     411       9     393     396     405     465      36
     393     396    -405     465      37     393     396    -405     465      38
     390     384     393     396      40     387     384     393     396      40
     384     393     396     405      41     384     393    -396     405      42
     384     393    -396     405      43     384     393    -396     405      44
     576     579     588     591       1     576     579    -588     591       2
     576     579    -588     591       3     567     561     576     579       6
     567     561    -576     579       7     567     561    -576     579       8
     561     576     579     582      11     561     576     579     585      11
     561     576     579     588      12     561     576    -579     588      13
     561     576    -579     588      11     555     519     513     567      14
     546     543     549     555      15     543     549     555     558      15
     531     528     543     546      16     531     528     543     549      16
     528     522     519     555      17     528     543    -549     555      15
     522     519     513     567      14     522     519     555     549      19
     522     519     555     558      19     522     528     543     546      16
     522     528    -543     546      22     522     528    -543     549      16
     519     513     567     561       9     519     522     528     531      18
     519     522     528     543      18     519     555    -549     543      15
     513     510    -504     561      23     513     510    -504     561      24
     513     519     522     528      17     513     519     555     549      19
     513     519     555     558      19     513     567     561     576       9
     510     504    -561     567       9     510     504     561     576      25
     510     504    -561     576      26     510     513     519     522      27
     510     513    -519     522      28     510     513    -519     522      29
     510     513    -519     522      30     510     513     519     555      14
     510     513    -567     561       9     504     510     513     519      31
     504     510    -513     519      24     504     510    -513     567      23
     504     510    -513     567      24     504     561    -567     513      32
     504     561    -567     513      33     504     561    -567     513      34
     504     561     576     579       6     504     561    -576     579       7
     504     561    -576     579       8     495     504     510     513      23
     495     504    -510     513      24     495     504     561     567      32
     495     504    -561     567      33     495     504    -561     567      34
     495     504     561     576       9     492     495     504     510       9
     492     495     504     561      36     492     495    -504     561      37
     492     495    -504     561      38     489     483     492     495      40
     486     483     492     495      40     483     492     495     504      41
     483     492    -495     504      42     483     492    -495     504      43
     483     492    -495     504      44     672     675     684     687       1
     672     675    -684     687       2     672     675    -684     687       3
     663     657     672     675       6     663     657    -672     675       7
     663     657    -672     675       8     657     672     675     678      11
     657     672     675     681      11     657     672     675     684      12
     657     672    -675     684      13     657     672    -675     684      11
     651     615     609     663      14     642     639     645     651      15
     639     645     651     654      15     627     624     639     642      16
     627     624     639     645      16     624     618     615     651      17
     624     639    -645     651      15     618     615     609     663      14
     618     615     651     645      19     618     615     651     654      19
     618     624     639     642      16     618     624    -639     642      22
     618     624    -639     645      16     615     609     663     657       9
     615     618     624     627      18     615     618     624     639      18
     615     651    -645     639      15     609     606    -600     657      23
     609     606    -600     657      24     609     615     618     624      17
     609     615     651     645      19     609     615     651     654      19
     609     663     657     672       9     606     600    -657     663       9
     606     600     657     672      25     606     600    -657     672      26
     606     609     615     618      27     606     609    -615     618      28
     606     609    -615     618      29     606     609    -615     618      30
     606     609     615     651      14     606     609    -663     657       9
     600     606     609     615      31     600     606    -609     615      24
     600     606    -609     663      23     600     606    -609     663      24
     600     657    -663     609      32     600     657    -663     609      33
     600     657    -663     609      34     600     657     672     675       6
     600     657    -672     675       7     600     657    -672     675       8
     591     600     606     609      23     591     600    -606     609      24
     591     600     657     663      32     591     600    -657     663      33
     591     600    -657     663      34     591     600     657     672       9
     588     591     600     606       9     588     591     600     657      36
     588     591    -600     657      37     588     591    -600     657      38
     585     579     588     591      40     582     579     588     591      40
     579     588     591     600      41     579     588    -591     600      42
     579     588    -591     600      43     579     588    -591     600      44
     768     771     780     783       1     768     771    -780     783       2
     768     771    -780     783       3     759     753     768     771       6
     759     753    -768     771       7     759     753    -768     771       8
     753     768     771     774      11     753     768     771     777      11
     753     768     771     780      12     753     768    -771     780      13
     753     768    -771     780      11     750     711     705     759      14
     738     726     723     750      59     738     741    -747     750      58
     729     726     723     750      59     729     726     738     741      46
     726     723     750     747      49     726     738    -741     747      58
     723     726     738     741      46     723     750    -747     741      50
     720     714    -711     750      51     720     723     726     729      59
     720     723     726     738      59     720     723     750     747      49
     714     711     705     759      14     714     711    -750     723      53
     714     711     750     747      53     714     720     723     726      54
     714     720    -723     750      54     711     705     759     753       9
     711     714    -720     723      52     711     750    -723     720      49
     711     750     723     726      49     711     750     747     741      50
     705     702    -696     753      23     705     702    -696     753      24
     705     711     714     720      51     705     711     750     723      53
     705     711     750     747      53     705     759     753     768       9
     702     696    -753     759       9     702     696     753     768      25
     702     696    -753     768      26     702     705     711     714      60
     702     705    -711     714      61     702     705    -711     714      62
     702     705     711     750      14     702     705    -759     753       9
     696     702     705     711      31     696     702    -705     711      24
     696     702    -705     759      23     696     702    -705     759      24
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     696     753    -759     705      34     696     753     768     771       6
     696     753    -768     771       7     696     753    -768     771       8
     687     696     702     705      23     687     696    -702     705      24
     687     696     753     759      32     687     696    -753     759      33
     687     696    -753     759      34     687     696     753     768       9
     684     687     696     702       9     684     687     696     753      36
     684     687    -696     753      37     684     687    -696     753      38
     681     675     684     687      40     678     675     684     687      40
     675     684     687     696      41     675     684    -687     696      42
     675     684    -687     696      43     675     684    -687     696      44
     867     870     879     882       1     867     870    -879     882       2
     867     870    -879     882       3     858     852     867     870       6
     858     852    -867     870       7     858     852    -867     870       8
     852     867     870     873      11     852     867     870     876      11
     852     867     870     879      12     852     867    -870     879      13
     852     867    -870     879      11     849     807     801     858      14
     837     834     846     849      46     828     822     819     849      48
     828     834    -846     849      46     825     822     819     849      48
     825     822     828     834      15     822     819     849     846      49
     822     828     834     837      47     822     828    -834     846      47
     819     822     828     834      15     819     849    -846     834      50
     816     810    -807     849      51     816     819     822     825      48
     816     819     822     828      48     816     819     849     846      49
     810     807     801     858      14     810     807    -849     819      53
     810     807     849     846      53     810     816     819     822      54
     810     816    -819     849      54     807     801     858     852       9
     807     810    -816     819      52     807     849    -819     816      49
     807     849     819     822      49     807     849     846     834      50
     801     798    -792     852      23     801     798    -792     852      24
     801     807     810     816      51     801     807     849     819      53
     801     807     849     846      53     801     858     852     867       9
     798     792    -852     858       9     798     792     852     867      25
     798     792    -852     867      26     798     801     807     810      55
     798     801    -807     810      56     798     801    -807     810      57
     798     801     807     849      14     798     801    -858     852       9
     792     798     801     807      31     792     798    -801     807      24
     792     798    -801     858      23     792     798    -801     858      24
     792     852    -858     801      32     792     852    -858     801      33
     792     852    -858     801      34     792     852     867     870       6
     792     852    -867     870       7     792     852    -867     870       8
     783     792     798     801      23     783     792    -798     801      24
     783     792     852     858      32     783     792    -852     858      33
     783     792    -852     858      34     783     792     852     867       9
     780     783     792     798       9     780     783     792     852      36
     780     783    -792     852      37     780     783    -792     852      38
     777     771     780     783      40     774     771     780     783      40
     771     780     783     792      41     771     780    -783     792      42
     771     780    -783     792      43     771     780    -783     792      44
     966     969     978     981       1     966     969    -978     981       2
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     957     951    -966     969       7     957     951    -966     969       8
     951     966     969     972      11     951     966     969     975      11
     951     966     969     978      12     951     966    -969     978      13
     951     966    -969     978      11     948     906     900     957      14
     936     933     945     948      46     927     921     918     948      48
     927     933    -945     948      46     924     921     918     948      48
     924     921     927     933      15     921     918     948     945      49
     921     927     933     936      47     921     927    -933     945      47
     918     921     927     933      15     918     948    -945     933      50
     915     909    -906     948      51     915     918     921     924      48
     915     918     921     927      48     915     918     948     945      49
     909     906     900     957      14     909     906    -948     918      53
     909     906     948     945      53     909     915     918     921      54
     909     915    -918     948      54     906     900     957     951       9
     906     909    -915     918      52     906     948    -918     915      49
     906     948     918     921      49     906     948     945     933      50
     900     897    -891     951      23     900     897    -891     951      24
     900     906     909     915      51     900     906     948     918      53
     900     906     948     945      53     900     957     951     966       9
     897     891    -951     957       9     897     891     951     966      25
     897     891    -951     966      26     897     900     906     909      55
     897     900    -906     909      56     897     900    -906     909      57
     897     900     906     948      14     897     900    -957     951       9
     891     897     900     906      31     891     897    -900     906      24
     891     897    -900     957      23     891     897    -900     957      24
     891     951    -957     900      32     891     951    -957     900      33
     891     951    -957     900      34     891     951     966     969       6
     891     951    -966     969       7     891     951    -966     969       8
     882     891     897     900      23     882     891    -897     900      24
     882     891     951     957      32     882     891    -951     957      33
     882     891    -951     957      34     882     891     951     966       9
     879     882     891     897       9     879     882     891     951      36
     879     882    -891     951      37     879     882    -891     951      38
     876     870     879     882      40     873     870     879     882      40
     870     879     882     891      41     870     879    -882     891      42
     870     879    -882     891      43     870     879    -882     891      44
    1065    1068    1077    1080       1    1065    1068   -1077    1080       2
    1065    1068   -1077    1080       3    1056    1050    1065    1068       6
    1056    1050   -1065    1068       7    1056    1050   -1065    1068       8
    1050    1065    1068    1071      11    1050    1065    1068    1074      11
    1050    1065    1068    1077      12    1050    1065   -1068    1077      13
    1050    1065   -1068    1077      11    1047    1005     999    1056      14
    1035    1032    1044    1047      46    1026    1020    1017    1047      48
    1026    1032   -1044    1047      46    1023    1020    1017    1047      48
    1023    1020    1026    1032      15    1020    1017    1047    1044      49
    1020    1026    1032    1035      47    1020    1026   -1032    1044      47
    1017    1020    1026    1032      15    1017    1047   -1044    1032      50
    1014    1008   -1005    1047      51    1014    1017    1020    1023      48
    1014    1017    1020    1026      48    1014    1017    1047    1044      49
    1008    1005     999    1056      14    1008    1005   -1047    1017      53
    1008    1005    1047    1044      53    1008    1014    1017    1020      54
    1008    1014   -1017    1047      54    1005     999    1056    1050       9
    1005    1008   -1014    1017      52    1005    1047   -1017    1014      49
    1005    1047    1017    1020      49    1005    1047    1044    1032      50
     999     996    -990    1050      23     999     996    -990    1050      24
     999    1005    1008    1014      51     999    1005    1047    1017      53
     999    1005    1047    1044      53     999    1056    1050    1065       9
     996     990   -1050    1056       9     996     990    1050    1065      25
     996     990   -1050    1065      26     996     999    1005    1008      55
     996     999   -1005    1008      56     996     999   -1005    1008      57
     996     999    1005    1047      14     996     999   -1056    1050       9
     990     996     999    1005      31     990     996    -999    1005      24
     990     996    -999    1056      23     990     996    -999    1056      24
     990    1050   -1056     999      32     990    1050   -1056     999      33
     990    1050   -1056     999      34     990    1050    1065    1068       6
     990    1050   -1065    1068       7     990    1050   -1065    1068       8
     981     990     996     999      23     981     990    -996     999      24
     981     990    1050    1056      32     981     990   -1050    1056      33
     981     990   -1050    1056      34     981     990    1050    1065       9
     978     981     990     996       9     978     981     990    1050      36
     978     981    -990    1050      37     978     981    -990    1050      38
     975     969     978     981      40     972     969     978     981      40
     969     978     981     990      41     969     978    -981     990      42
     969     978    -981     990      43     969     978    -981     990      44
    1161    1164    1173    1176       1    1161    1164   -1173    1176       2
    1161    1164   -1173    1176       3    1152    1146    1161    1164       6
    1152    1146   -1161    1164       7    1152    1146   -1161    1164       8
    1146    1161    1164    1167      11    1146    1161    1164    1170      11
    1146    1161    1164    1173      12    1146    1161   -1164    1173      13
    1146    1161   -1164    1173      11    1140    1104    1098    1152      14
    1131    1128    1134    1140      15    1128    1134    1140    1143      15
    1116    1113    1128    1131      16    1116    1113    1128    1134      16
    1113    1107    1104    1140      17    1113    1128   -1134    1140      15
    1107    1104    1098    1152      14    1107    1104    1140    1134      19
    1107    1104    1140    1143      19    1107    1113    1128    1131      16
    1107    1113   -1128    1131      22    1107    1113   -1128    1134      16
    1104    1098    1152    1146       9    1104    1107    1113    1116      18
    1104    1107    1113    1128      18    1104    1140   -1134    1128      15
    1098    1095   -1089    1146      23    1098    1095   -1089    1146      24
    1098    1104    1107    1113      17    1098    1104    1140    1134      19
    1098    1104    1140    1143      19    1098    1152    1146    1161       9
    1095    1089   -1146    1152       9    1095    1089    1146    1161      25
    1095    1089   -1146    1161      26    1095    1098    1104    1107      27
    1095    1098   -1104    1107      28    1095    1098   -1104    1107      29
    1095    1098   -1104    1107      30    1095    1098    1104    1140      14
    1095    1098   -1152    1146       9    1089    1095    1098    1104      31
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    1770    1827   -1842    1845       7    1770    1827   -1842    1845       8
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    1761    1770   -1827    1833      34    1761    1770    1827    1842       9
    1758    1761    1770    1776       9    1758    1761    1770    1827      36
    1758    1761   -1770    1827      37    1758    1761   -1770    1827      38
    1755    1749    1758    1761      40    1752    1749    1758    1761      40
    1749    1758    1761    1770      41    1749    1758   -1761    1770      42
    1749    1758   -1761    1770      43    1749    1758   -1761    1770      44
    1938    1941    1950    1953      63    1938    1941   -1950    1953      40
    1929    1923    1938    1941       6    1929    1923   -1938    1941       7
    1929    1923   -1938    1941       8    1923    1938    1941    1944      11
    1923    1938    1941    1947      11    1923    1938    1941    1950      12
    1923    1938   -1941    1950      13    1923    1938   -1941    1950      11
    1920    1881    1875    1929      14    1908    1896    1893    1920      59
    1908    1911   -1917    1920      58    1899    1896    1893    1920      59
    1899    1896    1908    1911      46    1896    1893    1920    1917      49
    1896    1908   -1911    1917      58    1893    1896    1908    1911      46
    1893    1920   -1917    1911      50    1890    1884   -1881    1920      51
    1890    1893    1896    1899      59    1890    1893    1896    1908      59
    1890    1893    1920    1917      49    1884    1881    1875    1929      14
    1884    1881   -1920    1893      53    1884    1881    1920    1917      53
    1884    1890    1893    1896      54    1884    1890   -1893    1920      54
    1881    1875    1929    1923       9    1881    1884   -1890    1893      52
    1881    1920   -1893    1890      49    1881    1920    1893    1896      49
    1881    1920    1917    1911      50    1875    1872   -1866    1923      23
    1875    1872   -1866    1923      24    1875    1881    1884    1890      51
    1875    1881    1920    1893      53    1875    1881    1920    1917      53
    1875    1929    1923    1938       9    1872    1866   -1923    1929       9
    1872    1866    1923    1938      25    1872    1866   -1923    1938      26
    1872    1875    1881    1884      60    1872    1875   -1881    1884      61
    1872    1875   -1881    1884      62    1872    1875    1881    1920      14
    1872    1875   -1929    1923       9    1866    1872    1875    1881      31
    1866    1872   -1875    1881      24    1866    1872   -1875    1929      23
    1866    1872   -1875    1929      24    1866    1923   -1929    1875      32
    1866    1923   -1929    1875      33    1866    1923   -1929    1875      34
    1866    1923    1938    1941       6    1866    1923   -1938    1941       7
    1866    1923   -1938    1941       8    1857    1866    1872    1875      23
    1857    1866   -1872    1875      24    1857    1866    1923    1929      32
    1857    1866   -1923    1929      33    1857    1866   -1923    1929      34
    1857    1866    1923    1938       9    1854    1857    1866    1872       9
    1854    1857    1866    1923      36    1854    1857   -1866    1923      37
    1854    1857   -1866    1923      38    1851    1845    1854    1857      40
    1848    1845    1854    1857      40    1845    1854    1857    1866      41
    1845    1854   -1857    1866      42    1845    1854   -1857    1866      43
    1845    1854   -1857    1866      44    2040    2043    2052    2055       1
    2040    2043   -2052    2055       2    2040    2043   -2052    2055       3
    2031    2025    2040    2043      10    2025    2040    2043    2046      40
    2025    2040    2043    2049      40    2025    2040    2043    2052      63
    2025    2040   -2043    2052      40    2022    1977    1971    2031      14
    2010    2007    2019    2022      46    2001    1995    1992    2022      48
    2001    2007   -2019    2022      46    1998    1995    1992    2022      48
    1998    1995    2001    2007      15    1995    1992    2022    2019      49
    1995    2001    2007    2010      47    1995    2001   -2007    2019      47
    1992    1995    2001    2007      15    1992    2022   -2019    2007      50
    1986    1980   -1977    2022      51    1986    1992    1995    1998      48
    1986    1992    1995    2001      48    1986    1992    2022    2019      49
    1983    1980    1977    2022      51    1983    1980    1986    1992      64
    1980    1977    1971    2031      14    1980    1977    2022    2019      53
    1980    1977   -2022    1992      53    1980    1986    1992    1995      47
    1980    1986   -1992    2022      47    1977    1971    2031    2025       9
    1977    1980   -1986    1992      64    1977    2022    2019    2007      50
    1977    2022   -1992    1986      49    1977    2022    1992    1995      49
    1971    1968   -1962    2025      23    1971    1968   -1962    2025      24
    1971    1977    1980    1983      51    1971    1977    1980    1986      51
    1971    1977    2022    2019      53    1971    1977    2022    1992      53
    1971    2031    2025    2040       9    1968    1962   -2025    2031       9
    1968    1962    2025    2040      25    1968    1962   -2025    2040      26
    1968    1971    1977    1980      55    1968    1971   -1977    1980      56
    1968    1971   -1977    1980      57    1968    1971    1977    2022      14
    1968    1971   -2031    2025       9    1962    1968    1971    1977      31
    1962    1968   -1971    1977      24    1962    1968   -1971    2031      23
    1962    1968   -1971    2031      24    1962    2025   -2031    1971      32
    1962    2025   -2031    1971      33    1962    2025   -2031    1971      34
    1962    2025    2040    2043      10    1953    1962    1968    1971      23
    1953    1962   -1968    1971      24    1953    1962    2025    2031      32
    1953    1962   -2025    2031      33    1953    1962   -2025    2031      34
    1953    1962    2025    2040       9    1950    1953    1962    1968      25
    1950    1953   -1962    1968      26    1950    1953    1962    2025       9
    1947    1941    1950    1953      40    1944    1941    1950    1953      40
    1941    1950    1953    1962      10    2139    2142    2151    2154       1
    2139    2142   -2151    2154       2    2139    2142   -2151    2154       3
    2130    2124    2139    2142       6    2130    2124   -2139    2142       7
    2130    2124   -2139    2142       8    2124    2139    2142    2145      11
    2124    2139    2142    2148      11    2124    2139    2142    2151      12
    2124    2139   -2142    2151      13    2124    2139   -2142    2151      11
    2121    2079    2073    2130      14    2109    2106    2118    2121      46
    2100    2094    2091    2121      48    2100    2106   -2118    2121      46
    2097    2094    2091    2121      48    2097    2094    2100    2106      15
    2094    2091    2121    2118      49    2094    2100    2106    2109      47
    2094    2100   -2106    2118      47    2091    2094    2100    2106      15
    2091    2121   -2118    2106      50    2088    2082   -2079    2121      51
    2088    2091    2094    2097      48    2088    2091    2094    2100      48
    2088    2091    2121    2118      49    2082    2079    2073    2130      14
    2082    2079   -2121    2091      53    2082    2079    2121    2118      53
    2082    2088    2091    2094      54    2082    2088   -2091    2121      54
    2079    2073    2130    2124       9    2079    2082   -2088    2091      52
    2079    2121   -2091    2088      49    2079    2121    2091    2094      49
    2079    2121    2118    2106      50    2073    2070   -2064    2124      23
    2073    2070   -2064    2124      24    2073    2079    2082    2088      51
    2073    2079    2121    2091      53    2073    2079    2121    2118      53
    2073    2130    2124    2139       9    2070    2064   -2124    2130       9
    2070    2064    2124    2139      25    2070    2064   -2124    2139      26
    2070    2073    2079    2082      55    2070    2073   -2079    2082      56
    2070    2073   -2079    2082      57    2070    2073    2079    2121      14
    2070    2073   -2130    2124       9    2064    2070    2073    2079      31
    2064    2070   -2073    2079      24    2064    2070   -2073    2130      23
    2064    2070   -2073    2130      24    2064    2124   -2130    2073      32
    2064    2124   -2130    2073      33    2064    2124   -2130    2073      34
    2064    2124    2139    2142       6    2064    2124   -2139    2142       7
    2064    2124   -2139    2142       8    2055    2064    2070    2073      23
    2055    2064   -2070    2073      24    2055    2064    2124    2130      32
    2055    2064   -2124    2130      33    2055    2064   -2124    2130      34
    2055    2064    2124    2139       9    2052    2055    2064    2070       9
    2052    2055    2064    2124      36    2052    2055   -2064    2124      37
    2052    2055   -2064    2124      38    2049    2043    2052    2055      40
    2046    2043    2052    2055      40    2043    2052    2055    2064      41
    2043    2052   -2055    2064      42    2043    2052   -2055    2064      43
    2043    2052   -2055    2064      44    2238    2241    2250    2253       1
    2238    2241   -2250    2253       2    2238    2241   -2250    2253       3
    2229    2223    2238    2241       6    2229    2223   -2238    2241       7
    2229    2223   -2238    2241       8    2223    2238    2241    2244      11
    2223    2238    2241    2247      11    2223    2238    2241    2250      12
    2223    2238   -2241    2250      13    2223    2238   -2241    2250      11
    2220    2178    2172    2229      14    2208    2205    2217    2220      46
    2199    2193    2190    2220      48    2199    2205   -2217    2220      46
    2196    2193    2190    2220      48    2196    2193    2199    2205      15
    2193    2190    2220    2217      49    2193    2199    2205    2208      47
    2193    2199   -2205    2217      47    2190    2193    2199    2205      15
    2190    2220   -2217    2205      50    2187    2181   -2178    2220      51
    2187    2190    2193    2196      48    2187    2190    2193    2199      48
    2187    2190    2220    2217      49    2181    2178    2172    2229      14
    2181    2178   -2220    2190      53    2181    2178    2220    2217      53
    2181    2187    2190    2193      54    2181    2187   -2190    2220      54
    2178    2172    2229    2223       9    2178    2181   -2187    2190      52
    2178    2220   -2190    2187      49    2178    2220    2190    2193      49
    2178    2220    2217    2205      50    2172    2169   -2163    2223      23
    2172    2169   -2163    2223      24    2172    2178    2181    2187      51
    2172    2178    2220    2190      53    2172    2178    2220    2217      53
    2172    2229    2223    2238       9    2169    2163   -2223    2229       9
    2169    2163    2223    2238      25    2169    2163   -2223    2238      26
    2169    2172    2178    2181      55    2169    2172   -2178    2181      56
    2169    2172   -2178    2181      57    2169    2172    2178    2220      14
    2169    2172   -2229    2223       9    2163    2169    2172    2178      31
    2163    2169   -2172    2178      24    2163    2169   -2172    2229      23
    2163    2169   -2172    2229      24    2163    2223   -2229    2172      32
    2163    2223   -2229    2172      33    2163    2223   -2229    2172      34
    2163    2223    2238    2241       6    2163    2223   -2238    2241       7
    2163    2223   -2238    2241       8    2154    2163    2169    2172      23
    2154    2163   -2169    2172      24    2154    2163    2223    2229      32
    2154    2163   -2223    2229      33    2154    2163   -2223    2229      34
    2154    2163    2223    2238       9    2151    2154    2163    2169       9
    2151    2154    2163    2223      36    2151    2154   -2163    2223      37
    2151    2154   -2163    2223      38    2148    2142    2151    2154      40
    2145    2142    2151    2154      40    2142    2151    2154    2163      41
    2142    2151   -2154    2163      42    2142    2151   -2154    2163      43
    2142    2151   -2154    2163      44    2316    2277    2271    2325      14
    2304    2292    2289    2316      59    2304    2307   -2313    2316      58
    2295    2292    2289    2316      59    2295    2292    2304    2307      46
    2292    2289    2316    2313      49    2292    2304   -2307    2313      58
    2289    2292    2304    2307      46    2289    2316   -2313    2307      50
    2286    2280   -2277    2316      51    2286    2289    2292    2295      59
    2286    2289    2292    2304      59    2286    2289    2316    2313      49
    2280    2277    2271    2325      14    2280    2277   -2316    2289      53
    2280    2277    2316    2313      53    2280    2286    2289    2292      54
    2280    2286   -2289    2316      54    2277    2271    2325    2319       9
    2277    2280   -2286    2289      52    2277    2316   -2289    2286      49
    2277    2316    2289    2292      49    2277    2316    2313    2307      50
    2271    2268   -2262    2319      23    2271    2268   -2262    2319      24
    2271    2277    2280    2286      51    2271    2277    2316    2289      53
    2271    2277    2316    2313      53    2271    2325    2319    2334       9
    2268    2262   -2319    2325       9    2268    2262    2319    2334      25
    2268    2262   -2319    2334      26    2268    2271    2277    2280      60
    2268    2271   -2277    2280      61    2268    2271   -2277    2280      62
    2268    2271    2277    2316      14    2268    2271   -2325    2319       9
    2262    2268    2271    2277      31    2262    2268   -2271    2277      24
    2262    2268   -2271    2325      23    2262    2268   -2271    2325      24
    2262    2319   -2325    2271      32    2262    2319   -2325    2271      33
    2262    2319   -2325    2271      34    2253    2262    2268    2271      23
    2253    2262   -2268    2271      24    2253    2262    2319    2325      32
    2253    2262   -2319    2325      33    2253    2262   -2319    2325      34
    2253    2262    2319    2334       9    2250    2253    2262    2268       9
    2250    2253    2262    2319      36    2250    2253   -2262    2319      37
    2250    2253   -2262    2319      38    2247    2241    2250    2253      40
    2244    2241    2250    2253      40    2241    2250    2253    2262      41
    2241    2250   -2253    2262      42    2241    2250   -2253    2262      43
    2241    2250   -2253    2262      44      30      60     -66     -69      65
      39      60     -54     -57      65      54      33     -39     -42      67
      66      33     -30     -24      66     126     156    -162    -165      65
     135     156    -150    -153      65     150     129    -135    -138      67
     162     129    -126    -120      66     252     243    -249    -261      67
     234     243    -237    -240      65     264     225    -222    -216      66
     351     342    -348    -360      67     333     342    -336    -339      65
     363     324    -321    -315      66     450     441    -447    -459      67
     432     441    -435    -438      65     462     423    -420    -414      66
     519     549    -555    -558      65     528     549    -543    -546      65
     543     522    -528    -531      67     555     522    -519    -513      66
     615     645    -651    -654      65     624     645    -639    -642      65
     639     618    -624    -627      67     651     618    -615    -609      66
     723     729    -726    -738      67     750     714    -711    -705      66
     837     828    -834    -846      67     819     828    -822    -825      65
     849     810    -807    -801      66     936     927    -933    -945      67
     918     927    -921    -924      65     948     909    -906    -900      66
    1035    1026   -1032   -1044      67    1017    1026   -1020   -1023      65
    1047    1008   -1005    -999      66    1104    1134   -1140   -1143      65
    1113    1134   -1128   -1131      65    1128    1107   -1113   -1116      67
    1140    1107   -1104   -1098      66    1200    1230   -1236   -1239      65
    1209    1230   -1224   -1227      65    1224    1203   -1209   -1212      67
    1236    1203   -1200   -1194      66    1308    1314   -1311   -1323      67
    1299    1335   -1296   -1290      66    1422    1413   -1419   -1431      67
    1404    1413   -1407   -1410      65    1434    1395   -1392   -1386      66
    1521    1512   -1518   -1530      67    1503    1512   -1506   -1509      65
    1533    1494   -1491   -1485      66    1620    1611   -1617   -1629      67
    1602    1611   -1605   -1608      65    1632    1593   -1590   -1584      66
    1689    1719   -1725   -1728      65    1698    1719   -1713   -1716      65
    1713    1692   -1698   -1701      67    1725    1692   -1689   -1683      66
    1785    1815   -1821   -1824      65    1794    1815   -1809   -1812      65
    1809    1788   -1794   -1797      67    1821    1788   -1785   -1779      66
    1893    1899   -1896   -1908      67    1884    1920   -1881   -1875      66
    2010    2001   -2007   -2019      67    1992    2001   -1995   -1998      65
    1986    1977   -1980   -1983      65    2022    1980   -1977   -1971      66
    2109    2100   -2106   -2118      67    2091    2100   -2094   -2097      65
    2121    2082   -2079   -2073      66    2208    2199   -2205   -2217      67
    2190    2199   -2193   -2196      65    2220    2181   -2178   -2172      66
    2289    2295   -2292   -2304      67    2280    2316   -2277   -2271      66
%FLAG EXCLUDED_ATOMS_LIST                                                       
%FORMAT(10I8)                                                                   
       2       3       4       5       6       3       4       5       6       7
       8      25       4       5       6       7       8       9      25      26
      27      30       5       6       7       8      25       6       7       8
      25       7       8       9      10      11      25      26      27      28
      29      30      31       8       9      25      26      27      30       9
      10      11      12      23      25      26      27      28      29      30
      10      11      12      13      14      21      23      24      25      26
      27      28      29      30      11      12      23      25      27      28
      29      12      13      14      15      19      21      22      23      24
      25      27      28      29      13      14      15      16      17      18
      19      20      21      23      24      27      14      15      19      23
      15      16      17      18      19      20      21      22      23      16
      17      18      19      20      21      17      18      19      18      19
      19      20      21      22      23      24      21      22      23      22
      23      24      23      24      24      27       0      26      27      28
      29      30      31      32      33      34      27      28      29      30
      31      28      29      30      31      29      30      30      31      32
      33      34      35      32      33      34      35      36      37      38
      33      34      35      34      35      35      36      37      38      39
      40      57      36      37      38      39      40      41      57      58
      59      62      37      38      39      40      57      38      39      40
      57      39      40      41      42      43      57      58      59      60
      61      62      63      40      41      57      58      59      62      41
      42      43      44      55      57      58      59      60      61      62
      42      43      44      45      46      53      55      56      57      58
      59      60      61      62      43      44      55      57      59      60
      61      44      45      46      47      51      53      54      55      56
      57      59      60      61      45      46      47      48      49      50
      51      52      53      55      56      59      46      47      51      55
      47      48      49      50      51      52      53      54      55      48
      49      50      51      52      53      49      50      51      50      51
      51      52      53      54      55      56      53      54      55      54
      55      56      55      56      56      59       0      58      59      60
      61      62      63      64      65      66      59      60      61      62
      63      60      61      62      63      61      62      62      63      64
      65      66      67      64      65      66      67      68      69      70
      65      66      67      66      67      67      68      69      70      71
      72      90      68      69      70      71      72      73      90      91
      92      95      69      70      71      72      90      70      71      72
      90      71      72      73      74      75      90      91      92      93
      94      95      96      72      73      90      91      92      95      73
      74      75      76      89      90      91      92      93      94      95
      74      75      76      77      78      79      88      89      90      91
      92      93      94      95      75      76      89      90      92      93
      94      76      77      78      79      80      84      88      89      90
      92      93      94      77      78      79      80      88      89      92
      78      79      89      79      80      81      82      88      89      80
      81      82      83      84      88      89      81      82      83      84
      85      88      89      82      83      84      89      83      84      85
      86      87      88      89      84      85      88      85      86      87
      88      89      86      87      88      89      87      88      88      89
      92      91      92      93      94      95      96      97      98      99
      92      93      94      95      96      93      94      95      96      94
      95      95      96      97      98      99     100      97      98      99
     100     101     102     103      98      99     100      99     100     100
     101     102     103     104     105     123     101     102     103     104
     105     106     123     124     125     128     102     103     104     105
     123     103     104     105     123     104     105     106     107     108
     123     124     125     126     127     128     129     105     106     123
     124     125     128     106     107     108     109     122     123     124
     125     126     127     128     107     108     109     110     111     112
     121     122     123     124     125     126     127     128     108     109
     122     123     125     126     127     109     110     111     112     113
     117     121     122     123     125     126     127     110     111     112
     113     121     122     125     111     112     122     112     113     114
     115     121     122     113     114     115     116     117     121     122
     114     115     116     117     118     121     122     115     116     117
     122     116     117     118     119     120     121     122     117     118
     121     118     119     120     121     122     119     120     121     122
     120     121     121     122     125     124     125     126     127     128
     129     130     131     132     125     126     127     128     129     126
     127     128     129     127     128     128     129     130     131     132
     133     130     131     132     133     134     135     136     131     132
     133     132     133     133     134     135     136     137     138     156
     134     135     136     137     138     139     156     157     158     161
     135     136     137     138     156     136     137     138     156     137
     138     139     140     141     156     157     158     159     160     161
     162     138     139     156     157     158     161     139     140     141
     142     155     156     157     158     159     160     161     140     141
     142     143     144     145     154     155     156     157     158     159
     160     161     141     142     155     156     158     159     160     142
     143     144     145     146     150     154     155     156     158     159
     160     143     144     145     146     154     155     158     144     145
     155     145     146     147     148     154     155     146     147     148
     149     150     154     155     147     148     149     150     151     154
     155     148     149     150     155     149     150     151     152     153
     154     155     150     151     154     151     152     153     154     155
     152     153     154     155     153     154     154     155     158     157
     158     159     160     161     162     163     164     165     158     159
     160     161     162     159     160     161     162     160     161     161
     162     163     164     165     166     163     164     165     166     167
     168     169     164     165     166     165     166     166     167     168
     169     170     171     188     167     168     169     170     171     172
     188     189     190     193     168     169     170     171     188     169
     170     171     188     170     171     172     173     174     188     189
     190     191     192     193     194     171     172     188     189     190
     193     172     173     174     175     186     188     189     190     191
     192     193     173     174     175     176     177     184     186     187
     188     189     190     191     192     193     174     175     186     188
     190     191     192     175     176     177     178     182     184     185
     186     187     188     190     191     192     176     177     178     179
     180     181     182     183     184     186     187     190     177     178
     182     186     178     179     180     181     182     183     184     185
     186     179     180     181     182     183     184     180     181     182
     181     182     182     183     184     185     186     187     184     185
     186     185     186     187     186     187     187     190       0     189
     190     191     192     193     194     195     196     197     190     191
     192     193     194     191     192     193     194     192     193     193
     194     195     196     197     198     195     196     197     198     199
     200     201     196     197     198     197     198     198     199     200
     201     202     203     220     199     200     201     202     203     204
     220     221     222     225     200     201     202     203     220     201
     202     203     220     202     203     204     205     206     220     221
     222     223     224     225     226     203     204     220     221     222
     225     204     205     206     207     218     220     221     222     223
     224     225     205     206     207     208     209     216     218     219
     220     221     222     223     224     225     206     207     218     220
     222     223     224     207     208     209     210     214     216     217
     218     219     220     222     223     224     208     209     210     211
     212     213     214     215     216     218     219     222     209     210
     214     218     210     211     212     213     214     215     216     217
     218     211     212     213     214     215     216     212     213     214
     213     214     214     215     216     217     218     219     216     217
     218     217     218     219     218     219     219     222       0     221
     222     223     224     225     226     227     228     229     222     223
     224     225     226     223     224     225     226     224     225     225
     226     227     228     229     230     227     228     229     230     231
     232     233     228     229     230     229     230     230     231     232
     233     234     235     252     231     232     233     234     235     236
     252     253     254     257     232     233     234     235     252     233
     234     235     252     234     235     236     237     238     252     253
     254     255     256     257     258     235     236     252     253     254
     257     236     237     238     239     251     252     253     254     255
     256     257     237     238     239     240     241     242     250     251
     252     253     254     255     256     257     238     239     251     252
     254     255     256     239     240     241     242     243     248     250
     251     252     254     255     256     240     241     242     243     250
     251     254     241     242     251     242     243     244     247     250
     251     243     244     245     246     247     248     250     251     244
     245     246     247     248     249     250     251     245     246     247
     248     251     246     247     247     248     249     250     251     249
     250     251     250     251     251     254     253     254     255     256
     257     258     259     260     261     254     255     256     257     258
     255     256     257     258     256     257     257     258     259     260
     261     262     259     260     261     262     263     264     265     260
     261     262     261     262     262     263     264     265     266     267
     285     263     264     265     266     267     268     285     286     287
     290     264     265     266     267     285     265     266     267     285
     266     267     268     269     270     285     286     287     288     289
     290     291     267     268     285     286     287     290     268     269
     270     271     284     285     286     287     288     289     290     269
     270     271     272     273     274     283     284     285     286     287
     288     289     290     270     271     284     285     287     288     289
     271     272     273     274     275     279     283     284     285     287
     288     289     272     273     274     275     283     284     287     273
     274     284     274     275     276     277     283     284     275     276
     277     278     279     283     284     276     277     278     279     280
     283     284     277     278     279     284     278     279     280     281
     282     283     284     279     280     283     280     281     282     283
     284     281     282     283     284     282     283     283     284     287
     286     287     288     289     290     291     292     293     294     287
     288     289     290     291     288     289     290     291     289     290
     290     291     292     293     294     295     292     293     294     295
     296     297     298     293     294     295     294     295     295     296
     297     298     299     300     318     296     297     298     299     300
     301     318     319     320     323     297     298     299     300     318
     298     299     300     318     299     300     301     302     303     318
     319     320     321     322     323     324     300     301     318     319
     320     323     301     302     303     304     317     318     319     320
     321     322     323     302     303     304     305     306     307     316
     317     318     319     320     321     322     323     303     304     317
     318     320     321     322     304     305     306     307     308     312
     316     317     318     320     321     322     305     306     307     308
     316     317     320     306     307     317     307     308     309     310
     316     317     308     309     310     311     312     316     317     309
     310     311     312     313     316     317     310     311     312     317
     311     312     313     314     315     316     317     312     313     316
     313     314     315     316     317     314     315     316     317     315
     316     316     317     320     319     320     321     322     323     324
     325     326     327     320     321     322     323     324     321     322
     323     324     322     323     323     324     325     326     327     328
     325     326     327     328     329     330     331     326     327     328
     327     328     328     329     330     331     332     333     351     329
     330     331     332     333     334     351     352     353     356     330
     331     332     333     351     331     332     333     351     332     333
     334     335     336     351     352     353     354     355     356     357
     333     334     351     352     353     356     334     335     336     337
     350     351     352     353     354     355     356     335     336     337
     338     339     340     349     350     351     352     353     354     355
     356     336     337     350     351     353     354     355     337     338
     339     340     341     345     349     350     351     353     354     355
     338     339     340     341     349     350     353     339     340     350
     340     341     342     343     349     350     341     342     343     344
     345     349     350     342     343     344     345     346     349     350
     343     344     345     350     344     345     346     347     348     349
     350     345     346     349     346     347     348     349     350     347
     348     349     350     348     349     349     350     353     352     353
     354     355     356     357     358     359     360     353     354     355
     356     357     354     355     356     357     355     356     356     357
     358     359     360     361     358     359     360     361     362     363
     364     359     360     361     360     361     361     362     363     364
     365     366     383     362     363     364     365     366     367     383
     384     385     388     363     364     365     366     383     364     365
     366     383     365     366     367     368     369     383     384     385
     386     387     388     389     366     367     383     384     385     388
     367     368     369     370     381     383     384     385     386     387
     388     368     369     370     371     372     379     381     382     383
     384     385     386     387     388     369     370     381     383     385
     386     387     370     371     372     373     377     379     380     381
     382     383     385     386     387     371     372     373     374     375
     376     377     378     379     381     382     385     372     373     377
     381     373     374     375     376     377     378     379     380     381
     374     375     376     377     378     379     375     376     377     376
     377     377     378     379     380     381     382     379     380     381
     380     381     382     381     382     382     385       0     384     385
     386     387     388     389     390     391     392     385     386     387
     388     389     386     387     388     389     387     388     388     389
     390     391     392     393     390     391     392     393     394     395
     396     391     392     393     392     393     393     394     395     396
     397     398     415     394     395     396     397     398     399     415
     416     417     420     395     396     397     398     415     396     397
     398     415     397     398     399     400     401     415     416     417
     418     419     420     421     398     399     415     416     417     420
     399     400     401     402     413     415     416     417     418     419
     420     400     401     402     403     404     411     413     414     415
     416     417     418     419     420     401     402     413     415     417
     418     419     402     403     404     405     409     411     412     413
     414     415     417     418     419     403     404     405     406     407
     408     409     410     411     413     414     417     404     405     409
     413     405     406     407     408     409     410     411     412     413
     406     407     408     409     410     411     407     408     409     408
     409     409     410     411     412     413     414     411     412     413
     412     413     414     413     414     414     417       0     416     417
     418     419     420     421     422     423     424     417     418     419
     420     421     418     419     420     421     419     420     420     421
     422     423     424     425     422     423     424     425     426     427
     428     423     424     425     424     425     425     426     427     428
     429     430     447     426     427     428     429     430     431     447
     448     449     452     427     428     429     430     447     428     429
     430     447     429     430     431     432     433     447     448     449
     450     451     452     453     430     431     447     448     449     452
     431     432     433     434     446     447     448     449     450     451
     452     432     433     434     435     436     437     445     446     447
     448     449     450     451     452     433     434     446     447     449
     450     451     434     435     436     437     438     443     445     446
     447     449     450     451     435     436     437     438     445     446
     449     436     437     446     437     438     439     442     445     446
     438     439     440     441     442     443     445     446     439     440
     441     442     443     444     445     446     440     441     442     443
     446     441     442     442     443     444     445     446     444     445
     446     445     446     446     449     448     449     450     451     452
     453     454     455     456     449     450     451     452     453     450
     451     452     453     451     452     452     453     454     455     456
     457     454     455     456     457     458     459     460     455     456
     457     456     457     457     458     459     460     461     462     480
     458     459     460     461     462     463     480     481     482     485
     459     460     461     462     480     460     461     462     480     461
     462     463     464     465     480     481     482     483     484     485
     486     462     463     480     481     482     485     463     464     465
     466     479     480     481     482     483     484     485     464     465
     466     467     468     469     478     479     480     481     482     483
     484     485     465     466     479     480     482     483     484     466
     467     468     469     470     474     478     479     480     482     483
     484     467     468     469     470     478     479     482     468     469
     479     469     470     471     472     478     479     470     471     472
     473     474     478     479     471     472     473     474     475     478
     479     472     473     474     479     473     474     475     476     477
     478     479     474     475     478     475     476     477     478     479
     476     477     478     479     477     478     478     479     482     481
     482     483     484     485     486     487     488     489     482     483
     484     485     486     483     484     485     486     484     485     485
     486     487     488     489     490     487     488     489     490     491
     492     493     488     489     490     489     490     490     491     492
     493     494     495     513     491     492     493     494     495     496
     513     514     515     518     492     493     494     495     513     493
     494     495     513     494     495     496     497     498     513     514
     515     516     517     518     519     495     496     513     514     515
     518     496     497     498     499     512     513     514     515     516
     517     518     497     498     499     500     501     502     511     512
     513     514     515     516     517     518     498     499     512     513
     515     516     517     499     500     501     502     503     507     511
     512     513     515     516     517     500     501     502     503     511
     512     515     501     502     512     502     503     504     505     511
     512     503     504     505     506     507     511     512     504     505
     506     507     508     511     512     505     506     507     512     506
     507     508     509     510     511     512     507     508     511     508
     509     510     511     512     509     510     511     512     510     511
     511     512     515     514     515     516     517     518     519     520
     521     522     515     516     517     518     519     516     517     518
     519     517     518     518     519     520     521     522     523     520
     521     522     523     524     525     526     521     522     523     522
     523     523     524     525     526     527     528     546     524     525
     526     527     528     529     546     547     548     551     525     526
     527     528     546     526     527     528     546     527     528     529
     530     531     546     547     548     549     550     551     552     528
     529     546     547     548     551     529     530     531     532     545
     546     547     548     549     550     551     530     531     532     533
     534     535     544     545     546     547     548     549     550     551
     531     532     545     546     548     549     550     532     533     534
     535     536     540     544     545     546     548     549     550     533
     534     535     536     544     545     548     534     535     545     535
     536     537     538     544     545     536     537     538     539     540
     544     545     537     538     539     540     541     544     545     538
     539     540     545     539     540     541     542     543     544     545
     540     541     544     541     542     543     544     545     542     543
     544     545     543     544     544     545     548     547     548     549
     550     551     552     553     554     555     548     549     550     551
     552     549     550     551     552     550     551     551     552     553
     554     555     556     553     554     555     556     557     558     559
     554     555     556     555     556     556     557     558     559     560
     561     578     557     558     559     560     561     562     578     579
     580     583     558     559     560     561     578     559     560     561
     578     560     561     562     563     564     578     579     580     581
     582     583     584     561     562     578     579     580     583     562
     563     564     565     576     578     579     580     581     582     583
     563     564     565     566     567     574     576     577     578     579
     580     581     582     583     564     565     576     578     580     581
     582     565     566     567     568     572     574     575     576     577
     578     580     581     582     566     567     568     569     570     571
     572     573     574     576     577     580     567     568     572     576
     568     569     570     571     572     573     574     575     576     569
     570     571     572     573     574     570     571     572     571     572
     572     573     574     575     576     577     574     575     576     575
     576     577     576     577     577     580       0     579     580     581
     582     583     584     585     586     587     580     581     582     583
     584     581     582     583     584     582     583     583     584     585
     586     587     588     585     586     587     588     589     590     591
     586     587     588     587     588     588     589     590     591     592
     593     610     589     590     591     592     593     594     610     611
     612     615     590     591     592     593     610     591     592     593
     610     592     593     594     595     596     610     611     612     613
     614     615     616     593     594     610     611     612     615     594
     595     596     597     608     610     611     612     613     614     615
     595     596     597     598     599     606     608     609     610     611
     612     613     614     615     596     597     608     610     612     613
     614     597     598     599     600     604     606     607     608     609
     610     612     613     614     598     599     600     601     602     603
     604     605     606     608     609     612     599     600     604     608
     600     601     602     603     604     605     606     607     608     601
     602     603     604     605     606     602     603     604     603     604
     604     605     606     607     608     609     606     607     608     607
     608     609     608     609     609     612       0     611     612     613
     614     615     616     617     618     619     612     613     614     615
     616     613     614     615     616     614     615     615     616     617
     618     619     620     617     618     619     620     621     622     623
     618     619     620     619     620     620     621     622     623     624
     625     642     621     622     623     624     625     626     642     643
     644     647     622     623     624     625     642     623     624     625
     642     624     625     626     627     628     642     643     644     645
     646     647     648     625     626     642     643     644     647     626
     627     628     629     641     642     643     644     645     646     647
     627     628     629     630     631     632     640     641     642     643
     644     645     646     647     628     629     641     642     644     645
     646     629     630     631     632     633     638     640     641     642
     644     645     646     630     631     632     633     640     641     644
     631     632     641     632     633     634     637     640     641     633
     634     635     636     637     638     640     641     634     635     636
     637     638     639     640     641     635     636     637     638     641
     636     637     637     638     639     640     641     639     640     641
     640     641     641     644     643     644     645     646     647     648
     649     650     651     644     645     646     647     648     645     646
     647     648     646     647     647     648     649     650     651     652
     649     650     651     652     653     654     655     650     651     652
     651     652     652     653     654     655     656     657     676     653
     654     655     656     657     658     676     677     678     681     654
     655     656     657     676     655     656     657     676     656     657
     658     659     660     676     677     678     679     680     681     682
     657     658     676     677     678     681     658     659     660     661
     675     676     677     678     679     680     681     659     660     661
     662     663     665     674     675     676     677     678     679     680
     681     660     661     675     676     678     679     680     661     662
     663     664     665     666     670     674     675     676     678     679
     680     662     663     664     665     666     674     675     678     663
     664     665     675     664     665     666     667     668     674     675
     665     666     675     666     667     668     669     670     674     675
     667     668     669     670     671     674     675     668     669     670
     675     669     670     671     672     673     674     675     670     671
     674     671     672     673     674     675     672     673     674     675
     673     674     674     675     678     677     678     679     680     681
     682     683     684     685     678     679     680     681     682     679
     680     681     682     680     681     681     682     683     684     685
     686     683     684     685     686     687     688     689     684     685
     686     685     686     686     687     688     689     690     691     709
     687     688     689     690     691     692     709     710     711     714
     688     689     690     691     709     689     690     691     709     690
     691     692     693     694     709     710     711     712     713     714
     715     691     692     709     710     711     714     692     693     694
     695     708     709     710     711     712     713     714     693     694
     695     696     697     698     707     708     709     710     711     712
     713     714     694     695     708     709     711     712     713     695
     696     697     698     699     703     707     708     709     711     712
     713     696     697     698     699     707     708     711     697     698
     708     698     699     700     701     707     708     699     700     701
     702     703     707     708     700     701     702     703     704     707
     708     701     702     703     708     702     703     704     705     706
     707     708     703     704     707     704     705     706     707     708
     705     706     707     708     706     707     707     708     711     710
     711     712     713     714     715     716     717     718     711     712
     713     714     715     712     713     714     715     713     714     714
     715     716     717     718     719     716     717     718     719     720
     721     722     717     718     719     718     719     719     720     721
     722     723     724     742     720     721     722     723     724     725
     742     743     744     747     721     722     723     724     742     722
     723     724     742     723     724     725     726     727     742     743
     744     745     746     747     748     724     725     742     743     744
     747     725     726     727     728     741     742     743     744     745
     746     747     726     727     728     729     730     731     740     741
     742     743     744     745     746     747     727     728     741     742
     744     745     746     728     729     730     731     732     736     740
     741     742     744     745     746     729     730     731     732     740
     741     744     730     731     741     731     732     733     734     740
     741     732     733     734     735     736     740     741     733     734
     735     736     737     740     741     734     735     736     741     735
     736     737     738     739     740     741     736     737     740     737
     738     739     740     741     738     739     740     741     739     740
     740     741     744     743     744     745     746     747     748     749
     750     751     744     745     746     747     748     745     746     747
     748     746     747     747     748     749     750     751     752     749
     750     751     752     753     754     755     750     751     752     751
     752     752     753     754     755     756     757     774     753     754
     755     756     757     758     774     775     776     779     754     755
     756     757     774     755     756     757     774     756     757     758
     759     760     774     775     776     777     778     779     780     757
     758     774     775     776     779     758     759     760     761     773
     774     775     776     777     778     779     759     760     761     762
     763     764     772     773     774     775     776     777     778     779
     760     761     773     774     776     777     778     761     762     763
     764     765     770     772     773     774     776     777     778     762
     763     764     765     772     773     776     763     764     773     764
     765     766     769     772     773     765     766     767     768     769
     770     772     773     766     767     768     769     770     771     772
     773     767     768     769     770     773     768     769     769     770
     771     772     773     771     772     773     772     773     773     776
     775     776     777     778     779     780     776     777     778     779
     780     777     778     779     780     778     779     779     780       0
%FLAG HBOND_ACOEF                                                               
%FORMAT(5E16.8)                                                                 

%FLAG HBOND_BCOEF                                                               
%FORMAT(5E16.8)                                                                 

%FLAG HBCUT                                                                     
%FORMAT(5E16.8)                                                                 

%FLAG AMBER_ATOM_TYPE                                                           
%FORMAT(20a4)                                                                   
HO  OH  CJ  H1  H1  CT  H1  OS  CT  H2  N*  CM  H4  CM  CT  HC  HC  HC  C   O   
NA  H   C   O   C7  H1  CT  HC  HC  OS  P   O2  O2  OS  CJ  H1  H1  CT  H1  OS  
CT  H2  N*  CM  H4  CM  CT  HC  HC  HC  C   O   NA  H   C   O   C7  H1  CT  HC  
HC  OS  P   O2  O2  OS  CJ  H1  H1  CT  H1  OS  CT  H2  N*  CK  H5  NB  CB  C   
O   NA  H   CA  N2  H   H   NC  CB  C7  H1  CT  HC  HC  OS  P   O2  O2  OS  CJ  
H1  H1  CT  H1  OS  CT  H2  N*  CK  H5  NB  CB  C   O   NA  H   CA  N2  H   H   
NC  CB  C7  H1  CT  HC  HC  OS  P   O2  O2  OS  CJ  H1  H1  CT  H1  OS  CT  H2  
N*  CK  H5  NB  CB  C   O   NA  H   CA  N2  H   H   NC  CB  C7  H1  CT  HC  HC  
OS  P   O2  O2  OS  CJ  H1  H1  CT  H1  OS  CT  H2  N*  CM  H4  CM  CT  HC  HC  
HC  C   O   NA  H   C   O   C7  H1  CT  HC  HC  OS  P   O2  O2  OS  CJ  H1  H1  
CT  H1  OS  CT  H2  N*  CM  H4  CM  CT  HC  HC  HC  C   O   NA  H   C   O   C7  
H1  CT  HC  HC  OS  P   O2  O2  OS  CJ  H1  H1  CT  H1  OS  CT  H2  N*  C2  H5  
NB  CB  CA  N2  H   H   NC  CQ  H5  NC  CB  C7  H1  CT  HC  HC  OS  P   O2  O2  
OS  CJ  H1  H1  CT  H1  OS  CT  H2  N*  CK  H5  NB  CB  C   O   NA  H   CA  N2  
H   H   NC  CB  C7  H1  CT  HC  HC  OS  P   O2  O2  OS  CJ  H1  H1  CT  H1  OS  
CT  H2  N*  CK  H5  NB  CB  C   O   NA  H   CA  N2  H   H   NC  CB  C7  H1  CT  
HC  HC  OS  P   O2  O2  OS  CJ  H1  H1  CT  H1  OS  CT  H2  N*  CK  H5  NB  CB  
C   O   NA  H   CA  N2  H   H   NC  CB  C7  H1  CT  HC  HC  OS  P   O2  O2  OS  
CJ  H1  H1  CT  H1  OS  CT  H2  N*  CM  H4  CM  CT  HC  HC  HC  C   O   NA  H   
C   O   C7  H1  CT  HC  HC  OS  P   O2  O2  OS  CJ  H1  H1  CT  H1  OS  CT  H2  
N*  CM  H4  CM  CT  HC  HC  HC  C   O   NA  H   C   O   C7  H1  CT  HC  HC  OS  
P   O2  O2  OS  CJ  H1  H1  CT  H1  OS  CT  H2  N*  C2  H5  NB  CB  CA  N2  H   
H   NC  CQ  H5  NC  CB  C7  H1  CT  HC  HC  OS  P   O2  O2  OS  CJ  H1  H1  CT  
H1  OS  CT  H2  N*  CK  H5  NB  CB  C   O   NA  H   CA  N2  H   H   NC  CB  C7  
H1  CT  HC  HC  OS  P   O2  O2  OS  CJ  H1  H1  CT  H1  OS  CT  H2  N*  CK  H5  
NB  CB  C   O   NA  H   CA  N2  H   H   NC  CB  C7  H1  CT  HC  HC  OS  P   O2  
O2  OS  CJ  H1  H1  CT  H1  OS  CT  H2  N*  CK  H5  NB  CB  C   O   NA  H   CA  
N2  H   H   NC  CB  C7  H1  CT  HC  HC  OS  P   O2  O2  OS  CJ  H1  H1  CT  H1  
OS  CT  H2  N*  CM  H4  CM  CT  HC  HC  HC  C   O   NA  H   C   O   C7  H1  CT  
HC  HC  OS  P   O2  O2  OS  CJ  H1  H1  CT  H1  OS  CT  H2  N*  CM  H4  CM  CT  
HC  HC  HC  C   O   NA  H   C   O   C7  H1  CT  HC  HC  OS  P   O2  O2  OS  CJ  
H1  H1  CT  H1  OS  CT  H2  N*  C2  H5  NB  CB  CA  N2  H   H   NC  CQ  H5  NC  
CB  C7  H1  CT  HC  HC  OS  P   O2  O2  OS  CT  H1  H1  CT  H1  OS  CT  H2  N*  
CK  O   NA  H   CB  C   O   NA  H   CA  N2  H   H   NC  CB  CT  H1  CT  HC  HC  
OS  P   O2  O2  OS  CJ  H1  H1  CT  H1  OS  CT  H2  N*  CK  H5  NB  CB  C   O   
NA  H   CA  N2  H   H   NC  CB  C7  H1  CT  HC  HC  OS  P   O2  O2  OS  CJ  H1  
H1  CT  H1  OS  CT  H2  N*  CK  H5  NB  CB  C   O   NA  H   CA  N2  H   H   NC  
CB  C7  H1  CT  HC  HC  OS  P   O2  O2  OS  CJ  H1  H1  CT  H1  OS  CT  H2  N*  
C2  H5  NB  CB  CA  N2  H   H   NC  CQ  H5  NC  CB  C7  H1  CT  HC  HC  OH  HO  
%FLAG TREE_CHAIN_CLASSIFICATION                                                 
%FORMAT(20a4)                                                                   
M   M   M   E   E   M   E   S   3   E   B   S   E   S   3   E   E   E   B   E   
B   E   B   E   M   E   B   E   E   M   M   E   E   M   M   E   E   M   E   S   
3   E   B   S   E   S   3   E   E   E   B   E   B   E   B   E   M   E   B   E   
E   M   M   E   E   M   M   E   E   M   E   S   3   E   B   S   E   E   B   B   
E   B   E   S   B   E   E   E   B   M   E   B   E   E   M   M   E   E   M   M   
E   E   M   E   S   3   E   B   S   E   E   B   B   E   B   E   S   B   E   E   
E   B   M   E   B   E   E   M   M   E   E   M   M   E   E   M   E   S   3   E   
B   S   E   E   B   B   E   B   E   S   B   E   E   E   B   M   E   B   E   E   
M   M   E   E   M   M   E   E   M   E   S   3   E   B   S   E   S   3   E   E   
E   B   E   B   E   B   E   M   E   B   E   E   M   M   E   E   M   M   E   E   
M   E   S   3   E   B   S   E   S   3   E   E   E   B   E   B   E   B   E   M   
E   B   E   E   M   M   E   E   M   M   E   E   M   E   S   3   E   B   S   E   
E   B   B   B   E   E   S   S   E   E   B   M   E   B   E   E   M   M   E   E   
M   M   E   E   M   E   S   3   E   B   S   E   E   B   B   E   B   E   S   B   
E   E   E   B   M   E   B   E   E   M   M   E   E   M   M   E   E   M   E   S   
3   E   B   S   E   E   B   B   E   B   E   S   B   E   E   E   B   M   E   B   
E   E   M   M   E   E   M   M   E   E   M   E   S   3   E   B   S   E   E   B   
B   E   B   E   S   B   E   E   E   B   M   E   B   E   E   M   M   E   E   M   
M   E   E   M   E   S   3   E   B   S   E   S   3   E   E   E   B   E   B   E   
B   E   M   E   B   E   E   M   M   E   E   M   M   E   E   M   E   S   3   E   
B   S   E   S   3   E   E   E   B   E   B   E   B   E   M   E   B   E   E   M   
M   E   E   M   M   E   E   M   E   S   3   E   B   S   E   E   B   B   B   E   
E   S   S   E   E   B   M   E   B   E   E   M   M   E   E   M   M   E   E   M   
E   S   3   E   B   S   E   E   B   B   E   B   E   S   B   E   E   E   B   M   
E   B   E   E   M   M   E   E   M   M   E   E   M   E   S   3   E   B   S   E   
E   B   B   E   B   E   S   B   E   E   E   B   M   E   B   E   E   M   M   E   
E   M   M   E   E   M   E   S   3   E   B   S   E   E   B   B   E   B   E   S   
B   E   E   E   B   M   E   B   E   E   M   M   E   E   M   M   E   E   M   E   
S   3   E   B   S   E   S   3   E   E   E   B   E   B   E   B   E   M   E   B   
E   E   M   M   E   E   M   M   E   E   M   E   S   3   E   B   S   E   S   3   
E   E   E   B   E   B   E   B   E   M   E   B   E   E   M   M   E   E   M   M   
E   E   M   E   S   3   E   B   S   E   E   B   B   B   E   E   S   S   E   E   
B   M   E   B   E   E   M   M   E   E   M   M   E   E   M   E   S   3   E   B   
S   E   S   E   B   B   E   B   E   S   B   E   E   E   B   M   E   B   E   E   
M   M   E   E   M   M   E   E   M   E   S   3   E   B   S   E   E   B   B   E   
B   E   S   B   E   E   E   B   M   E   B   E   E   M   M   E   E   M   M   E   
E   M   E   S   3   E   B   S   E   E   B   B   E   B   E   S   B   E   E   E   
B   M   E   B   E   E   M   M   E   E   M   M   E   E   M   E   S   3   E   B   
S   E   E   B   B   B   E   E   S   S   E   E   B   M   E   B   E   E   M   M   
%FLAG JOIN_ARRAY                                                                
%FORMAT(10I8)                                                                   
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       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       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
       0       0       0       0       0       0       0       0       0       0
%FLAG RADIUS_SET                                                                
%FORMAT(1a80)                                                                   
modified Bondi radii (mbondi)                                                   
%FLAG RADII                                                                     
%FORMAT(5E16.8)                                                                 
  8.00000000E-01  1.50000000E+00  1.70000000E+00  1.30000000E+00  1.30000000E+00
  1.70000000E+00  1.30000000E+00  1.50000000E+00  1.70000000E+00  1.30000000E+00
  1.55000000E+00  1.70000000E+00  1.30000000E+00  1.70000000E+00  1.70000000E+00
  1.30000000E+00  1.30000000E+00  1.30000000E+00  1.70000000E+00  1.50000000E+00
  1.55000000E+00  1.30000000E+00  1.70000000E+00  1.50000000E+00  1.70000000E+00
  1.30000000E+00  1.70000000E+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  1.70000000E+00  1.30000000E+00  1.50000000E+00
  1.70000000E+00  1.30000000E+00  1.55000000E+00  1.70000000E+00  1.30000000E+00
  1.70000000E+00  1.70000000E+00  1.30000000E+00  1.30000000E+00  1.30000000E+00
  1.70000000E+00  1.50000000E+00  1.55000000E+00  1.30000000E+00  1.70000000E+00
  1.50000000E+00  1.70000000E+00  1.30000000E+00  1.70000000E+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  1.70000000E+00
  1.30000000E+00  1.50000000E+00  1.70000000E+00  1.30000000E+00  1.55000000E+00
  1.70000000E+00  1.30000000E+00  1.55000000E+00  1.70000000E+00  1.70000000E+00
  1.50000000E+00  1.55000000E+00  1.30000000E+00  1.70000000E+00  1.55000000E+00
  1.30000000E+00  1.30000000E+00  1.55000000E+00  1.70000000E+00  1.70000000E+00
  1.30000000E+00  1.70000000E+00  1.30000000E+00  1.30000000E+00  1.50000000E+00
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%FORMAT(5E16.8)                                                                 
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%FLAG IPOL                                                                      
%FORMAT(1I8)                                                                    
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