%VERSION  VERSION_STAMP = V0001.000  DATE = 01/26/09  17:37:49                  
%FLAG TITLE                                                                     
%FORMAT(20a4)                                                                   
                                                                                
%FLAG POINTERS                                                                  
%FORMAT(10I8)                                                                   
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%FLAG ATOM_NAME                                                                 
%FORMAT(20a4)                                                                   
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%FLAG CHARGE                                                                    
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%FLAG MASS                                                                      
%FORMAT(5E16.8)                                                                 
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  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
  1.00800000E+00
%FLAG ATOM_TYPE_INDEX                                                           
%FORMAT(10I8)                                                                   
       1       2       3       4       4       3       4       5       3       6
       7       8       9       8      10       8       7      11      11       7
       8      12       3       4       3      13      13       5      14      12
      12       5       3       4       4       3       4       5       3       6
       7       8      15       7       8       8      12       7      11       8
       7      11      11       7       8       3       4       3      13      13
       5      14      12      12       5       3       4       4       3       4
       5       3       6       7       8      15       7       8       8      12
       7      11       8       7      11      11       7       8       3       4
       3      13      13       5      14      12      12       5       3       4
       4       3       4       5       3       6       7       8       9       8
      10       8       7      11      11       7       8      12       3       4
       3      13      13       5      14      12      12       5       3       4
       4       3       4       5       3       6       7       8       9       8
      10       8       7      11      11       7       8      12       3       4
       3      13      13       5      14      12      12       5       3       4
       4       3       4       5       3       6       7       8      15       7
       8       8      12       7      11       8       7      11      11       7
       8       3       4       3      13      13       2       1       1       2
       3       4       4       3       4       5       3       6       7       8
       9       8      10       8       7      11      11       7       8      12
       3       4       3      13      13       5      14      12      12       5
       3       4       4       3       4       5       3       6       7       8
      15       7       8       8      12       7      11       8       7      11
      11       7       8       3       4       3      13      13       5      14
      12      12       5       3       4       4       3       4       5       3
       6       7       8      15       7       8       8      12       7      11
       8       7      11      11       7       8       3       4       3      13
      13       5      14      12      12       5       3       4       4       3
       4       5       3       6       7       8       9       8      10       8
       7      11      11       7       8      12       3       4       3      13
      13       5      14      12      12       5       3       4       4       3
       4       5       3       6       7       8       9       8      10       8
       7      11      11       7       8      12       3       4       3      13
      13       5      14      12      12       5       3       4       4       3
       4       5       3       6       7       8      15       7       8       8
      12       7      11       8       7      11      11       7       8       3
       4       3      13      13       2       1
%FLAG NUMBER_EXCLUDED_ATOMS                                                     
%FORMAT(10I8)                                                                   
       5       7      10       5       4      12       6      11      14       7
      12       9       4       7       3       6       4       2       1       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       9       4       7
       3       6       4       2       1       2       2       1       9       5
       4       2       1       5       7       3       2       7      10       5
       4      12       6      11      14       7      12       9       4       7
       3       6       4       2       1       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       6       5       4       2       1       1       1       5       7
      10       5       4      12       6      11      14       7      12       9
       4       7       3       6       4       2       1       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       9       4       7       3       6
       4       2       1       2       2       1       9       5       4       2
       1       5       7       3       2       7      10       5       4      12
       6      11      14       7      12       9       4       7       3       6
       4       2       1       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       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     106       2       3       5       8      12
      17      23      30      38      47      57      68      80      93     107
       4       5       6       9      13      18      24      31      39      48
      58      69      81      94     108       7       8       9      10      14
      19      25      32      40      49      59      70      82      95     109
      11      12      13      14      15      20      26      33      41      50
      60      71      83      96     110      16      17      18      19      20
      21      27      34      42      51      61      72      84      97     111
      22      23      24      25      26      27      28      35      43      52
      62      73      85      98     112      29      30      31      32      33
      34      35      36      44      53      63      74      86      99     113
      37      38      39      40      41      42      43      44      45      54
      64      75      87     100     114      46      47      48      49      50
      51      52      53      54      55      65      76      88     101     115
      56      57      58      59      60      61      62      63      64      65
      66      77      89     102     116      67      68      69      70      71
      72      73      74      75      76      77      78      90     103     117
      79      80      81      82      83      84      85      86      87      88
      89      90      91     104     118      92      93      94      95      96
      97      98      99     100     101     102     103     104     105     119
     106     107     108     109     110     111     112     113     114     115
     116     117     118     119     120
%FLAG RESIDUE_LABEL                                                             
%FORMAT(20a4)                                                                   
DC5 DG  DG  DC  DC  DG3 DC5 DG  DG  DC  DC  DG3 
%FLAG RESIDUE_POINTER                                                           
%FORMAT(10I8)                                                                   
       1      29      62      95     125     155     189     217     250     283
     313     343
%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  4.57000000E+02  4.34000000E+02  4.81000000E+02  4.83000000E+02
  3.67000000E+02  4.27000000E+02  3.67000000E+02  5.49000000E+02  4.48000000E+02
  4.24000000E+02  3.40000000E+02  3.37000000E+02  3.20000000E+02  5.53000000E+02
  4.61000000E+02  4.34000000E+02  4.27000000E+02  4.18000000E+02  4.47000000E+02
  5.20000000E+02  4.14000000E+02  3.67000000E+02  5.29000000E+02  4.40000000E+02
  4.36000000E+02  5.25000000E+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  1.35800000E+00  1.01000000E+00  1.34000000E+00  1.33900000E+00
  1.08000000E+00  1.43300000E+00  1.08000000E+00  1.35000000E+00  1.36500000E+00
  1.38300000E+00  1.09000000E+00  1.47500000E+00  1.41000000E+00  9.60000000E-01
  1.35400000E+00  1.01000000E+00  1.38100000E+00  1.38800000E+00  1.41900000E+00
  1.37000000E+00  1.39100000E+00  1.08000000E+00  1.30400000E+00  1.37100000E+00
  1.37400000E+00  1.48000000E+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  8.00000000E+01  3.50000000E+01
  7.00000000E+01  5.00000000E+01  7.00000000E+01  5.00000000E+01  7.00000000E+01
  7.00000000E+01  5.00000000E+01  7.00000000E+01  5.00000000E+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  6.00000000E+01  3.50000000E+01  5.00000000E+01
  5.00000000E+01  5.50000000E+01  7.00000000E+01  5.00000000E+01  7.00000000E+01
  7.00000000E+01  8.00000000E+01  6.30000000E+01  5.00000000E+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  1.40000000E+02
%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  2.13802925E+00  2.09439600E+00
  2.08217869E+00  2.09439600E+00  2.10312265E+00  2.15199189E+00  2.09614133E+00
  2.12057595E+00  2.08916001E+00  2.12232128E+00  2.08916001E+00  2.04203610E+00
  1.91113635E+00  2.07868803E+00  2.11533996E+00  2.06996138E+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  1.89368305E+00  1.95826026E+00  2.05948940E+00  2.02458280E+00
  2.15199189E+00  2.10486798E+00  2.08043336E+00  2.03854544E+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  2.09265067E+00
%FLAG DIHEDRAL_FORCE_CONSTANT                                                   
%FORMAT(5E16.8)                                                                 
  1.20000000E+00  2.50000000E-01  2.50000000E-01  0.00000000E+00  3.83333333E-01
  1.55555556E-01  0.00000000E+00  2.40000000E+00  4.80000000E+00  4.00000000E+00
  2.55000000E+00  1.85000000E+00  6.65000000E+00  1.45000000E+00  1.00000000E-01
  3.83000000E-01  1.17500000E+00  1.44000000E-01  2.50000000E+00  6.50000000E-01
  2.00000000E-01  2.50000000E-01  1.80000000E-01  1.60000000E-01  1.66666667E-01
  1.50000000E+00  3.00000000E+00  1.35000000E+00  5.45000000E+00  4.15000000E+00
  1.70000000E+00  1.00000000E+01  1.65000000E+00  1.05000000E+01  1.00000000E+00
  1.10000000E+00
%FLAG DIHEDRAL_PERIODICITY                                                      
%FORMAT(5E16.8)                                                                 
  2.00000000E+00  3.00000000E+00  1.00000000E+00  3.00000000E+00  3.00000000E+00
  3.00000000E+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
  3.00000000E+00  2.00000000E+00  3.00000000E+00  1.00000000E+00  2.00000000E+00
  1.00000000E+00  2.00000000E+00  3.00000000E+00  3.00000000E+00  3.00000000E+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
%FLAG DIHEDRAL_PHASE                                                            
%FORMAT(5E16.8)                                                                 
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+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
  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00  0.00000000E+00
  3.14159400E+00  3.14159400E+00  0.00000000E+00  0.00000000E+00  0.00000000E+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
  3.14159400E+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
%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  6.00750218E+04  8.59947003E+04  4.33325458E+03  4.68711055E+04
  2.82099197E+03  7.91627154E+04  7.62451550E+04  4.64559155E+03  5.71629601E+03
  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  8.90987508E+01
  1.39982777E-01  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
  4.77908183E+04  1.02595236E+03  3.79876399E+05  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  6.55825601E+03  1.07193646E+02  5.44261042E+04
  7.51607703E+03  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
  2.26202022E+05  8.41065839E+03  1.64263766E+06  2.54238516E+05  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  3.76169105E+03
  4.90239937E+01  3.23283631E+04  4.33325458E+03  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  1.16187983E+02  1.18043746E+02  1.63092814E+01  9.73010751E+01
  1.31591746E+01  1.26451907E+02  1.04660679E+02  1.66953734E+01  1.85196588E+01
  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  2.33864085E+00
  9.37598976E-02  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
  1.03580945E+02  1.53505284E+01  5.64885984E+02  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  2.00642027E+01  2.59456373E+00  1.11805549E+02
  2.17257828E+01  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
  2.22617115E+02  4.34187588E+01  1.16041466E+03  2.38716853E+02  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  1.50233639E+01
  1.73473071E+00  8.51921330E+01  1.63092814E+01  1.87626421E+02  1.20953369E+01
%FLAG BONDS_INC_HYDROGEN                                                        
%FORMAT(10I8)                                                                   
      72      75       2      72      78       2      66      69       3      48
      51       8      48      54       8      39      42      11      33      36
      13      24      27      17      15      18       3       6       9       3
       6      12       3       0       3      20     171     174       2     171
     177       2     165     168       3     150     153       8     150     156
       8     141     144      22     123     126      28     114     117      17
     105     108       3      96      99       3      96     102       3     270
     273       2     270     276       2     264     267       3     249     252
       8     249     255       8     240     243      22     222     225      28
     213     216      17     204     207       3     195     198       3     195
     201       3     360     363       2     360     366       2     354     357
       3     336     339       8     336     342       8     327     330      11
     321     324      13     312     315      17     303     306       3     294
     297       3     294     300       3     450     453       2     450     456
       2     444     447       3     426     429       8     426     432       8
     417     420      11     411     414      13     402     405      17     393
     396       3     384     387       3     384     390       3     558     561
      20     549     552       2     549     555       2     543     546       3
     528     531       8     528     534       8     519     522      22     501
     504      28     492     495      17     483     486       3     474     477
       3     474     480       3     636     639       2     636     642       2
     630     633       3     612     615       8     612     618       8     603
     606      11     597     600      13     588     591      17     579     582
       3     570     573       3     570     576       3     564     567      20
     735     738       2     735     741       2     729     732       3     714
     717       8     714     720       8     705     708      22     687     690
      28     678     681      17     669     672       3     660     663       3
     660     666       3     834     837       2     834     840       2     828
     831       3     813     816       8     813     819       8     804     807
      22     786     789      28     777     780      17     768     771       3
     759     762       3     759     765       3     924     927       2     924
     930       2     918     921       3     900     903       8     900     906
       8     891     894      11     885     888      13     876     879      17
     867     870       3     858     861       3     858     864       3    1014
    1017       2    1014    1020       2    1008    1011       3     990     993
       8     990     996       8     981     984      11     975     978      13
     966     969      17     957     960       3     948     951       3     948
     954       3    1122    1125      20    1113    1116       2    1113    1119
       2    1107    1110       3    1092    1095       8    1092    1098       8
    1083    1086      22    1065    1068      28    1056    1059      17    1047
    1050       3    1038    1041       3    1038    1044       3
%FLAG BONDS_WITHOUT_HYDROGEN                                                    
%FORMAT(10I8)                                                                   
      81      84       1      66      72       4      66      81       5      60
      63       6      57      60       7      45      48       9      45      57
      10      39      45      12      33      39      14      30      33      15
      30      60      16      24      30      18      24      72       4      21
      24       5      15      21       5      15      66       4       6      15
       4       3       6      19     180     183       1     165     171       4
     165     180       5     159     162      21     147     150       9     147
     159      10     141     147      23     135     138       6     135     141
      24     132     135      25     132     162      26     129     132      27
     123     129      29     120     123      30     120     162      31     114
     120      18     114     171       4     111     114       5     105     111
       5     105     165       4      96     105       4      93      96       5
      84      87      32      84      90      32      84      93       1     279
     282       1     264     270       4     264     279       5     258     261
      21     246     249       9     246     258      10     240     246      23
     234     237       6     234     240      24     231     234      25     231
     261      26     228     231      27     222     228      29     219     222
      30     219     261      31     213     219      18     213     270       4
     210     213       5     204     210       5     204     264       4     195
     204       4     192     195       5     183     186      32     183     189
      32     183     192       1     369     372       1     354     360       4
     354     369       5     348     351       6     345     348       7     333
     336       9     333     345      10     327     333      12     321     327
      14     318     321      15     318     348      16     312     318      18
     312     360       4     309     312       5     303     309       5     303
     354       4     294     303       4     291     294       5     282     285
      32     282     288      32     282     291       1     459     462       1
     444     450       4     444     459       5     438     441       6     435
     438       7     423     426       9     423     435      10     417     423
      12     411     417      14     408     411      15     408     438      16
     402     408      18     402     450       4     399     402       5     393
     399       5     393     444       4     384     393       4     381     384
       5     372     375      32     372     378      32     372     381       1
     543     549       4     543     558      19     537     540      21     525
     528       9     525     537      10     519     525      23     513     516
       6     513     519      24     510     513      25     510     540      26
     507     510      27     501     507      29     498     501      30     498
     540      31     492     498      18     492     549       4     489     492
       5     483     489       5     483     543       4     474     483       4
     471     474       5     462     465      32     462     468      32     462
     471       1     645     648       1     630     636       4     630     645
       5     624     627       6     621     624       7     609     612       9
     609     621      10     603     609      12     597     603      14     594
     597      15     594     624      16     588     594      18     588     636
       4     585     588       5     579     585       5     579     630       4
     570     579       4     567     570      19     744     747       1     729
     735       4     729     744       5     723     726      21     711     714
       9     711     723      10     705     711      23     699     702       6
     699     705      24     696     699      25     696     726      26     693
     696      27     687     693      29     684     687      30     684     726
      31     678     684      18     678     735       4     675     678       5
     669     675       5     669     729       4     660     669       4     657
     660       5     648     651      32     648     654      32     648     657
       1     843     846       1     828     834       4     828     843       5
     822     825      21     810     813       9     810     822      10     804
     810      23     798     801       6     798     804      24     795     798
      25     795     825      26     792     795      27     786     792      29
     783     786      30     783     825      31     777     783      18     777
     834       4     774     777       5     768     774       5     768     828
       4     759     768       4     756     759       5     747     750      32
     747     753      32     747     756       1     933     936       1     918
     924       4     918     933       5     912     915       6     909     912
       7     897     900       9     897     909      10     891     897      12
     885     891      14     882     885      15     882     912      16     876
     882      18     876     924       4     873     876       5     867     873
       5     867     918       4     858     867       4     855     858       5
     846     849      32     846     852      32     846     855       1    1023
    1026       1    1008    1014       4    1008    1023       5    1002    1005
       6     999    1002       7     987     990       9     987     999      10
     981     987      12     975     981      14     972     975      15     972
    1002      16     966     972      18     966    1014       4     963     966
       5     957     963       5     957    1008       4     948     957       4
     945     948       5     936     939      32     936     942      32     936
     945       1    1107    1113       4    1107    1122      19    1101    1104
      21    1089    1092       9    1089    1101      10    1083    1089      23
    1077    1080       6    1077    1083      24    1074    1077      25    1074
    1104      26    1071    1074      27    1065    1071      29    1062    1065
      30    1062    1104      31    1056    1062      18    1056    1113       4
    1053    1056       5    1047    1053       5    1047    1107       4    1038
    1047       4    1035    1038       5    1026    1029      32    1026    1032
      32    1026    1035       1
%FLAG ANGLES_INC_HYDROGEN                                                       
%FORMAT(10I8)                                                                   
      75      72      78       3      69      66      72       5      69      66
      81       6      66      72      75       7      66      72      78       7
      51      48      54      10      45      48      51      12      45      48
      54      12      42      39      45      14      36      33      39      17
      33      39      42      19      30      33      36      22      27      24
      30      26      27      24      72      27      24      72      75       7
      24      72      78       7      21      24      27      31      18      15
      21       6      18      15      66       5      15      66      69       5
      12       6      15       5       9       6      12      34       9       6
      15       5       6      15      18       5       3       6       9      35
       3       6      12      35       0       3       6      37     174     171
     177       3     168     165     171       5     168     165     180       6
     165     171     174       7     165     171     177       7     153     150
     156      10     147     150     153      12     147     150     156      12
     144     141     147      39     135     141     144      44     126     123
     129      51     120     123     126      54     117     114     120      26
     117     114     171      27     114     171     174       7     114     171
     177       7     111     114     117      31     108     105     111       6
     108     105     165       5     105     165     168       5     102      96
     105       5      99      96     102      34      99      96     105       5
      96     105     108       5      93      96      99       6      93      96
     102       6     273     270     276       3     267     264     270       5
     267     264     279       6     264     270     273       7     264     270
     276       7     252     249     255      10     246     249     252      12
     246     249     255      12     243     240     246      39     234     240
     243      44     225     222     228      51     219     222     225      54
     216     213     219      26     216     213     270      27     213     270
     273       7     213     270     276       7     210     213     216      31
     207     204     210       6     207     204     264       5     204     264
     267       5     201     195     204       5     198     195     201      34
     198     195     204       5     195     204     207       5     192     195
     198       6     192     195     201       6     363     360     366       3
     357     354     360       5     357     354     369       6     354     360
     363       7     354     360     366       7     339     336     342      10
     333     336     339      12     333     336     342      12     330     327
     333      14     324     321     327      17     321     327     330      19
     318     321     324      22     315     312     318      26     315     312
     360      27     312     360     363       7     312     360     366       7
     309     312     315      31     306     303     309       6     306     303
     354       5     303     354     357       5     300     294     303       5
     297     294     300      34     297     294     303       5     294     303
     306       5     291     294     297       6     291     294     300       6
     453     450     456       3     447     444     450       5     447     444
     459       6     444     450     453       7     444     450     456       7
     429     426     432      10     423     426     429      12     423     426
     432      12     420     417     423      14     414     411     417      17
     411     417     420      19     408     411     414      22     405     402
     408      26     405     402     450      27     402     450     453       7
     402     450     456       7     399     402     405      31     396     393
     399       6     396     393     444       5     393     444     447       5
     390     384     393       5     387     384     390      34     387     384
     393       5     384     393     396       5     381     384     387       6
     381     384     390       6     552     549     555       3     546     543
     549       5     546     543     558      35     543     549     552       7
     543     549     555       7     543     558     561      37     531     528
     534      10     525     528     531      12     525     528     534      12
     522     519     525      39     513     519     522      44     504     501
     507      51     498     501     504      54     495     492     498      26
     495     492     549      27     492     549     552       7     492     549
     555       7     489     492     495      31     486     483     489       6
     486     483     543       5     483     543     546       5     480     474
     483       5     477     474     480      34     477     474     483       5
     474     483     486       5     471     474     477       6     471     474
     480       6     639     636     642       3     633     630     636       5
     633     630     645       6     630     636     639       7     630     636
     642       7     615     612     618      10     609     612     615      12
     609     612     618      12     606     603     609      14     600     597
     603      17     597     603     606      19     594     597     600      22
     591     588     594      26     591     588     636      27     588     636
     639       7     588     636     642       7     585     588     591      31
     582     579     585       6     582     579     630       5     579     630
     633       5     576     570     579       5     573     570     576      34
     573     570     579       5     570     579     582       5     567     570
     573      35     567     570     576      35     564     567     570      37
     738     735     741       3     732     729     735       5     732     729
     744       6     729     735     738       7     729     735     741       7
     717     714     720      10     711     714     717      12     711     714
     720      12     708     705     711      39     699     705     708      44
     690     687     693      51     684     687     690      54     681     678
     684      26     681     678     735      27     678     735     738       7
     678     735     741       7     675     678     681      31     672     669
     675       6     672     669     729       5     669     729     732       5
     666     660     669       5     663     660     666      34     663     660
     669       5     660     669     672       5     657     660     663       6
     657     660     666       6     837     834     840       3     831     828
     834       5     831     828     843       6     828     834     837       7
     828     834     840       7     816     813     819      10     810     813
     816      12     810     813     819      12     807     804     810      39
     798     804     807      44     789     786     792      51     783     786
     789      54     780     777     783      26     780     777     834      27
     777     834     837       7     777     834     840       7     774     777
     780      31     771     768     774       6     771     768     828       5
     768     828     831       5     765     759     768       5     762     759
     765      34     762     759     768       5     759     768     771       5
     756     759     762       6     756     759     765       6     927     924
     930       3     921     918     924       5     921     918     933       6
     918     924     927       7     918     924     930       7     903     900
     906      10     897     900     903      12     897     900     906      12
     894     891     897      14     888     885     891      17     885     891
     894      19     882     885     888      22     879     876     882      26
     879     876     924      27     876     924     927       7     876     924
     930       7     873     876     879      31     870     867     873       6
     870     867     918       5     867     918     921       5     864     858
     867       5     861     858     864      34     861     858     867       5
     858     867     870       5     855     858     861       6     855     858
     864       6    1017    1014    1020       3    1011    1008    1014       5
    1011    1008    1023       6    1008    1014    1017       7    1008    1014
    1020       7     993     990     996      10     987     990     993      12
     987     990     996      12     984     981     987      14     978     975
     981      17     975     981     984      19     972     975     978      22
     969     966     972      26     969     966    1014      27     966    1014
    1017       7     966    1014    1020       7     963     966     969      31
     960     957     963       6     960     957    1008       5     957    1008
    1011       5     954     948     957       5     951     948     954      34
     951     948     957       5     948     957     960       5     945     948
     951       6     945     948     954       6    1116    1113    1119       3
    1110    1107    1113       5    1110    1107    1122      35    1107    1113
    1116       7    1107    1113    1119       7    1107    1122    1125      37
    1095    1092    1098      10    1089    1092    1095      12    1089    1092
    1098      12    1086    1083    1089      39    1077    1083    1086      44
    1068    1065    1071      51    1062    1065    1068      54    1059    1056
    1062      26    1059    1056    1113      27    1056    1113    1116       7
    1056    1113    1119       7    1053    1056    1059      31    1050    1047
    1053       6    1050    1047    1107       5    1047    1107    1110       5
    1044    1038    1047       5    1041    1038    1044      34    1041    1038
    1047       5    1038    1047    1050       5    1035    1038    1041       6
    1035    1038    1044       6
%FLAG ANGLES_WITHOUT_HYDROGEN                                                   
%FORMAT(10I8)                                                                   
      81      84      87       1      81      84      90       1      81      84
      93       2      72      66      81       4      66      81      84       8
      57      60      63       9      48      45      57      11      45      57
      60      13      39      45      48      15      39      45      57      16
      33      30      60      18      33      39      45      20      30      24
      72      21      30      33      39      23      30      60      57      24
      30      60      63      25      24      30      33      28      24      30
      60      29      24      72      66      30      21      15      66       4
      21      24      30      32      21      24      72       4      15      21
      24      33      15      66      72      30      15      66      81       4
       6      15      21       4       6      15      66      30       3       6
      15      36     180     183     186       1     180     183     189       1
     180     183     192       2     171     165     180       4     165     180
     183       8     150     147     159      11     147     159     162      38
     141     147     150      40     141     147     159      41     138     135
     141      42     135     132     162      43     135     141     147      45
     132     135     138      46     132     135     141      47     132     162
     159      48     129     132     135      49     129     132     162      50
     123     120     162      52     123     129     132      53     120     114
     171      21     120     123     129      55     120     162     132      56
     120     162     159      57     114     120     123      58     114     120
     162      59     114     171     165      30     111     105     165       4
     111     114     120      32     111     114     171       4     105     111
     114      33     105     165     171      30     105     165     180       4
      96     105     111       4      96     105     165      30      93      96
     105       4      90      84      93       1      87      84      90      60
      87      84      93       1      84      93      96       8     279     282
     285       1     279     282     288       1     279     282     291       2
     270     264     279       4     264     279     282       8     249     246
     258      11     246     258     261      38     240     246     249      40
     240     246     258      41     237     234     240      42     234     231
     261      43     234     240     246      45     231     234     237      46
     231     234     240      47     231     261     258      48     228     231
     234      49     228     231     261      50     222     219     261      52
     222     228     231      53     219     213     270      21     219     222
     228      55     219     261     231      56     219     261     258      57
     213     219     222      58     213     219     261      59     213     270
     264      30     210     204     264       4     210     213     219      32
     210     213     270       4     204     210     213      33     204     264
     270      30     204     264     279       4     195     204     210       4
     195     204     264      30     192     195     204       4     189     183
     192       1     186     183     189      60     186     183     192       1
     183     192     195       8     369     372     375       1     369     372
     378       1     369     372     381       2     360     354     369       4
     354     369     372       8     345     348     351       9     336     333
     345      11     333     345     348      13     327     333     336      15
     327     333     345      16     321     318     348      18     321     327
     333      20     318     312     360      21     318     321     327      23
     318     348     345      24     318     348     351      25     312     318
     321      28     312     318     348      29     312     360     354      30
     309     303     354       4     309     312     318      32     309     312
     360       4     303     309     312      33     303     354     360      30
     303     354     369       4     294     303     309       4     294     303
     354      30     291     294     303       4     288     282     291       1
     285     282     288      60     285     282     291       1     282     291
     294       8     459     462     465       1     459     462     468       1
     459     462     471       2     450     444     459       4     444     459
     462       8     435     438     441       9     426     423     435      11
     423     435     438      13     417     423     426      15     417     423
     435      16     411     408     438      18     411     417     423      20
     408     402     450      21     408     411     417      23     408     438
     435      24     408     438     441      25     402     408     411      28
     402     408     438      29     402     450     444      30     399     393
     444       4     399     402     408      32     399     402     450       4
     393     399     402      33     393     444     450      30     393     444
     459       4     384     393     399       4     384     393     444      30
     381     384     393       4     378     372     381       1     375     372
     378      60     375     372     381       1     372     381     384       8
     549     543     558      36     528     525     537      11     525     537
     540      38     519     525     528      40     519     525     537      41
     516     513     519      42     513     510     540      43     513     519
     525      45     510     513     516      46     510     513     519      47
     510     540     537      48     507     510     513      49     507     510
     540      50     501     498     540      52     501     507     510      53
     498     492     549      21     498     501     507      55     498     540
     510      56     498     540     537      57     492     498     501      58
     492     498     540      59     492     549     543      30     489     483
     543       4     489     492     498      32     489     492     549       4
     483     489     492      33     483     543     549      30     483     543
     558      36     474     483     489       4     474     483     543      30
     471     474     483       4     468     462     471       1     465     462
     468      60     465     462     471       1     462     471     474       8
     645     648     651       1     645     648     654       1     645     648
     657       2     636     630     645       4     630     645     648       8
     621     624     627       9     612     609     621      11     609     621
     624      13     603     609     612      15     603     609     621      16
     597     594     624      18     597     603     609      20     594     588
     636      21     594     597     603      23     594     624     621      24
     594     624     627      25     588     594     597      28     588     594
     624      29     588     636     630      30     585     579     630       4
     585     588     594      32     585     588     636       4     579     585
     588      33     579     630     636      30     579     630     645       4
     570     579     585       4     570     579     630      30     567     570
     579      36     744     747     750       1     744     747     753       1
     744     747     756       2     735     729     744       4     729     744
     747       8     714     711     723      11     711     723     726      38
     705     711     714      40     705     711     723      41     702     699
     705      42     699     696     726      43     699     705     711      45
     696     699     702      46     696     699     705      47     696     726
     723      48     693     696     699      49     693     696     726      50
     687     684     726      52     687     693     696      53     684     678
     735      21     684     687     693      55     684     726     696      56
     684     726     723      57     678     684     687      58     678     684
     726      59     678     735     729      30     675     669     729       4
     675     678     684      32     675     678     735       4     669     675
     678      33     669     729     735      30     669     729     744       4
     660     669     675       4     660     669     729      30     657     660
     669       4     654     648     657       1     651     648     654      60
     651     648     657       1     648     657     660       8     843     846
     849       1     843     846     852       1     843     846     855       2
     834     828     843       4     828     843     846       8     813     810
     822      11     810     822     825      38     804     810     813      40
     804     810     822      41     801     798     804      42     798     795
     825      43     798     804     810      45     795     798     801      46
     795     798     804      47     795     825     822      48     792     795
     798      49     792     795     825      50     786     783     825      52
     786     792     795      53     783     777     834      21     783     786
     792      55     783     825     795      56     783     825     822      57
     777     783     786      58     777     783     825      59     777     834
     828      30     774     768     828       4     774     777     783      32
     774     777     834       4     768     774     777      33     768     828
     834      30     768     828     843       4     759     768     774       4
     759     768     828      30     756     759     768       4     753     747
     756       1     750     747     753      60     750     747     756       1
     747     756     759       8     933     936     939       1     933     936
     942       1     933     936     945       2     924     918     933       4
     918     933     936       8     909     912     915       9     900     897
     909      11     897     909     912      13     891     897     900      15
     891     897     909      16     885     882     912      18     885     891
     897      20     882     876     924      21     882     885     891      23
     882     912     909      24     882     912     915      25     876     882
     885      28     876     882     912      29     876     924     918      30
     873     867     918       4     873     876     882      32     873     876
     924       4     867     873     876      33     867     918     924      30
     867     918     933       4     858     867     873       4     858     867
     918      30     855     858     867       4     852     846     855       1
     849     846     852      60     849     846     855       1     846     855
     858       8    1023    1026    1029       1    1023    1026    1032       1
    1023    1026    1035       2    1014    1008    1023       4    1008    1023
    1026       8     999    1002    1005       9     990     987     999      11
     987     999    1002      13     981     987     990      15     981     987
     999      16     975     972    1002      18     975     981     987      20
     972     966    1014      21     972     975     981      23     972    1002
     999      24     972    1002    1005      25     966     972     975      28
     966     972    1002      29     966    1014    1008      30     963     957
    1008       4     963     966     972      32     963     966    1014       4
     957     963     966      33     957    1008    1014      30     957    1008
    1023       4     948     957     963       4     948     957    1008      30
     945     948     957       4     942     936     945       1     939     936
     942      60     939     936     945       1     936     945     948       8
    1113    1107    1122      36    1092    1089    1101      11    1089    1101
    1104      38    1083    1089    1092      40    1083    1089    1101      41
    1080    1077    1083      42    1077    1074    1104      43    1077    1083
    1089      45    1074    1077    1080      46    1074    1077    1083      47
    1074    1104    1101      48    1071    1074    1077      49    1071    1074
    1104      50    1065    1062    1104      52    1065    1071    1074      53
    1062    1056    1113      21    1062    1065    1071      55    1062    1104
    1074      56    1062    1104    1101      57    1056    1062    1065      58
    1056    1062    1104      59    1056    1113    1107      30    1053    1047
    1107       4    1053    1056    1062      32    1053    1056    1113       4
    1047    1053    1056      33    1047    1107    1113      30    1047    1107
    1122      36    1038    1047    1053       4    1038    1047    1107      30
    1035    1038    1047       4    1032    1026    1035       1    1029    1026
    1032      60    1029    1026    1035       1    1026    1035    1038       8
%FLAG DIHEDRALS_INC_HYDROGEN                                                    
%FORMAT(10I8)                                                                   
      78      72      66      81       3      78      72     -66      81       4
      75      72      66      81       3      75      72     -66      81       4
      69      66      72      75       6      69      66      72      78       6
      69      66      81      84       5      54      48      45      57       8
      51      48      45      57       8      42      39      45      48      11
      42      39      45      57      11      39      45      48      51       8
      39      45      48      54       8      36      33      30      60      12
      36      33      39      42      13      36      33      39      45      13
      30      24      72      75       6      30      24      72      78       6
      30      33      39      42      13      27      24      30      33       7
      27      24      30      60       7      27      24      72      66       6
      27      24      72      75       6      27      24      72      78       6
      24      30      33      36      12      24      72      66      69       6
      21      15      66      69       3      21      15     -66      69       4
      21      24      72      75       3      21      24     -72      75       4
      21      24      72      78       3      21      24     -72      78       4
      18      15      21      24       5      18      15      66      69       6
      18      15      66      72       6      18      15      66      81       3
      18      15     -66      81       4      15      21      24      27       5
      15      66      72      75      24      15      66      72      78      24
      12       6      15      18       6      12       6      15      21       3
      12       6     -15      21       4      12       6      15      66       6
       9       6      15      18       6       9       6      15      21       3
       9       6     -15      21       4       9       6      15      66       6
       6      15      66      69       6       3       6      15      18       3
       3       6     -15      18       4       0       3       6       9      25
       0       3       6      12      25       0       3       6      15       3
       0       3      -6      15      24     177     171     165     180       3
     177     171    -165     180       4     174     171     165     180       3
     174     171    -165     180       4     168     165     171     174       6
     168     165     171     177       6     168     165     180     183       5
     156     150     147     159       8     153     150     147     159       8
     144     141     147     150      26     144     141     147     159      26
     141     147     150     153       8     141     147     150     156       8
     138     135     141     144      28     132     135     141     144      28
     126     123     120     162      31     126     123     129     132      32
     120     114     171     174       6     120     114     171     177       6
     117     114     120     123       7     117     114     120     162       7
     117     114     171     165       6     117     114     171     174       6
     117     114     171     177       6     114     120     123     126      31
     114     171     165     168       6     111     105     165     168       3
     111     105    -165     168       4     111     114     171     174       3
     111     114    -171     174       4     111     114     171     177       3
     111     114    -171     177       4     108     105     111     114       5
     108     105     165     168       6     108     105     165     171       6
     108     105     165     180       3     108     105    -165     180       4
     105     111     114     117       5     105     165     171     174      24
     105     165     171     177      24     102      96     105     108       6
     102      96     105     111       3     102      96    -105     111       4
     102      96     105     165       6      99      96     105     108       6
      99      96     105     111       3      99      96    -105     111       4
      99      96     105     165       6      96     105     165     168       6
      93      96     105     108       3      93      96    -105     108       4
      84      93      96      99       5      84      93      96     102       5
     276     270     264     279       3     276     270    -264     279       4
     273     270     264     279       3     273     270    -264     279       4
     267     264     270     273       6     267     264     270     276       6
     267     264     279     282       5     255     249     246     258       8
     252     249     246     258       8     243     240     246     249      26
     243     240     246     258      26     240     246     249     252       8
     240     246     249     255       8     237     234     240     243      28
     231     234     240     243      28     225     222     219     261      31
     225     222     228     231      32     219     213     270     273       6
     219     213     270     276       6     216     213     219     222       7
     216     213     219     261       7     216     213     270     264       6
     216     213     270     273       6     216     213     270     276       6
     213     219     222     225      31     213     270     264     267       6
     210     204     264     267       3     210     204    -264     267       4
     210     213     270     273       3     210     213    -270     273       4
     210     213     270     276       3     210     213    -270     276       4
     207     204     210     213       5     207     204     264     267       6
     207     204     264     270       6     207     204     264     279       3
     207     204    -264     279       4     204     210     213     216       5
     204     264     270     273      24     204     264     270     276      24
     201     195     204     207       6     201     195     204     210       3
     201     195    -204     210       4     201     195     204     264       6
     198     195     204     207       6     198     195     204     210       3
     198     195    -204     210       4     198     195     204     264       6
     195     204     264     267       6     192     195     204     207       3
     192     195    -204     207       4     183     192     195     198       5
     183     192     195     201       5     366     360     354     369       3
     366     360    -354     369       4     363     360     354     369       3
     363     360    -354     369       4     357     354     360     363       6
     357     354     360     366       6     357     354     369     372       5
     342     336     333     345       8     339     336     333     345       8
     330     327     333     336      11     330     327     333     345      11
     327     333     336     339       8     327     333     336     342       8
     324     321     318     348      12     324     321     327     330      13
     324     321     327     333      13     318     312     360     363       6
     318     312     360     366       6     318     321     327     330      13
     315     312     318     321       7     315     312     318     348       7
     315     312     360     354       6     315     312     360     363       6
     315     312     360     366       6     312     318     321     324      12
     312     360     354     357       6     309     303     354     357       3
     309     303    -354     357       4     309     312     360     363       3
     309     312    -360     363       4     309     312     360     366       3
     309     312    -360     366       4     306     303     309     312       5
     306     303     354     357       6     306     303     354     360       6
     306     303     354     369       3     306     303    -354     369       4
     303     309     312     315       5     303     354     360     363      24
     303     354     360     366      24     300     294     303     306       6
     300     294     303     309       3     300     294    -303     309       4
     300     294     303     354       6     297     294     303     306       6
     297     294     303     309       3     297     294    -303     309       4
     297     294     303     354       6     294     303     354     357       6
     291     294     303     306       3     291     294    -303     306       4
     282     291     294     297       5     282     291     294     300       5
     456     450     444     459       3     456     450    -444     459       4
     453     450     444     459       3     453     450    -444     459       4
     447     444     450     453       6     447     444     450     456       6
     447     444     459     462       5     432     426     423     435       8
     429     426     423     435       8     420     417     423     426      11
     420     417     423     435      11     417     423     426     429       8
     417     423     426     432       8     414     411     408     438      12
     414     411     417     420      13     414     411     417     423      13
     408     402     450     453       6     408     402     450     456       6
     408     411     417     420      13     405     402     408     411       7
     405     402     408     438       7     405     402     450     444       6
     405     402     450     453       6     405     402     450     456       6
     402     408     411     414      12     402     450     444     447       6
     399     393     444     447       3     399     393    -444     447       4
     399     402     450     453       3     399     402    -450     453       4
     399     402     450     456       3     399     402    -450     456       4
     396     393     399     402       5     396     393     444     447       6
     396     393     444     450       6     396     393     444     459       3
     396     393    -444     459       4     393     399     402     405       5
     393     444     450     453      24     393     444     450     456      24
     390     384     393     396       6     390     384     393     399       3
     390     384    -393     399       4     390     384     393     444       6
     387     384     393     396       6     387     384     393     399       3
     387     384    -393     399       4     387     384     393     444       6
     384     393     444     447       6     381     384     393     396       3
     381     384    -393     396       4     372     381     384     387       5
     372     381     384     390       5     555     549     543     558       3
     555     549    -543     558       4     552     549     543     558       3
     552     549    -543     558       4     549     543     558     561       3
     549     543    -558     561      24     546     543     549     552       6
     546     543     549     555       6     546     543     558     561      25
     534     528     525     537       8     531     528     525     537       8
     522     519     525     528      26     522     519     525     537      26
     519     525     528     531       8     519     525     528     534       8
     516     513     519     522      28     510     513     519     522      28
     504     501     498     540      31     504     501     507     510      32
     498     492     549     552       6     498     492     549     555       6
     495     492     498     501       7     495     492     498     540       7
     495     492     549     543       6     495     492     549     552       6
     495     492     549     555       6     492     498     501     504      31
     492     549     543     546       6     489     483     543     546       3
     489     483    -543     546       4     489     492     549     552       3
     489     492    -549     552       4     489     492     549     555       3
     489     492    -549     555       4     486     483     489     492       5
     486     483     543     546       6     486     483     543     549       6
     486     483     543     558       3     486     483    -543     558       4
     483     489     492     495       5     483     543     549     552      24
     483     543     549     555      24     483     543     558     561       3
     483     543    -558     561      24     480     474     483     486       6
     480     474     483     489       3     480     474    -483     489       4
     480     474     483     543       6     477     474     483     486       6
     477     474     483     489       3     477     474    -483     489       4
     477     474     483     543       6     474     483     543     546       6
     471     474     483     486       3     471     474    -483     486       4
     462     471     474     477       5     462     471     474     480       5
     642     636     630     645       3     642     636    -630     645       4
     639     636     630     645       3     639     636    -630     645       4
     633     630     636     639       6     633     630     636     642       6
     633     630     645     648       5     618     612     609     621       8
     615     612     609     621       8     606     603     609     612      11
     606     603     609     621      11     603     609     612     615       8
     603     609     612     618       8     600     597     594     624      12
     600     597     603     606      13     600     597     603     609      13
     594     588     636     639       6     594     588     636     642       6
     594     597     603     606      13     591     588     594     597       7
     591     588     594     624       7     591     588     636     630       6
     591     588     636     639       6     591     588     636     642       6
     588     594     597     600      12     588     636     630     633       6
     585     579     630     633       3     585     579    -630     633       4
     585     588     636     639       3     585     588    -636     639       4
     585     588     636     642       3     585     588    -636     642       4
     582     579     585     588       5     582     579     630     633       6
     582     579     630     636       6     582     579     630     645       3
     582     579    -630     645       4     579     585     588     591       5
     579     630     636     639      24     579     630     636     642      24
     576     570     579     582       6     576     570     579     585       3
     576     570    -579     585       4     576     570     579     630       6
     573     570     579     582       6     573     570     579     585       3
     573     570    -579     585       4     573     570     579     630       6
     570     579     630     633       6     567     570     579     582       3
     567     570    -579     582       4     564     567     570     573      25
     564     567     570     576      25     564     567     570     579       3
     564     567    -570     579      24     741     735     729     744       3
     741     735    -729     744       4     738     735     729     744       3
     738     735    -729     744       4     732     729     735     738       6
     732     729     735     741       6     732     729     744     747       5
     720     714     711     723       8     717     714     711     723       8
     708     705     711     714      26     708     705     711     723      26
     705     711     714     717       8     705     711     714     720       8
     702     699     705     708      28     696     699     705     708      28
     690     687     684     726      31     690     687     693     696      32
     684     678     735     738       6     684     678     735     741       6
     681     678     684     687       7     681     678     684     726       7
     681     678     735     729       6     681     678     735     738       6
     681     678     735     741       6     678     684     687     690      31
     678     735     729     732       6     675     669     729     732       3
     675     669    -729     732       4     675     678     735     738       3
     675     678    -735     738       4     675     678     735     741       3
     675     678    -735     741       4     672     669     675     678       5
     672     669     729     732       6     672     669     729     735       6
     672     669     729     744       3     672     669    -729     744       4
     669     675     678     681       5     669     729     735     738      24
     669     729     735     741      24     666     660     669     672       6
     666     660     669     675       3     666     660    -669     675       4
     666     660     669     729       6     663     660     669     672       6
     663     660     669     675       3     663     660    -669     675       4
     663     660     669     729       6     660     669     729     732       6
     657     660     669     672       3     657     660    -669     672       4
     648     657     660     663       5     648     657     660     666       5
     840     834     828     843       3     840     834    -828     843       4
     837     834     828     843       3     837     834    -828     843       4
     831     828     834     837       6     831     828     834     840       6
     831     828     843     846       5     819     813     810     822       8
     816     813     810     822       8     807     804     810     813      26
     807     804     810     822      26     804     810     813     816       8
     804     810     813     819       8     801     798     804     807      28
     795     798     804     807      28     789     786     783     825      31
     789     786     792     795      32     783     777     834     837       6
     783     777     834     840       6     780     777     783     786       7
     780     777     783     825       7     780     777     834     828       6
     780     777     834     837       6     780     777     834     840       6
     777     783     786     789      31     777     834     828     831       6
     774     768     828     831       3     774     768    -828     831       4
     774     777     834     837       3     774     777    -834     837       4
     774     777     834     840       3     774     777    -834     840       4
     771     768     774     777       5     771     768     828     831       6
     771     768     828     834       6     771     768     828     843       3
     771     768    -828     843       4     768     774     777     780       5
     768     828     834     837      24     768     828     834     840      24
     765     759     768     771       6     765     759     768     774       3
     765     759    -768     774       4     765     759     768     828       6
     762     759     768     771       6     762     759     768     774       3
     762     759    -768     774       4     762     759     768     828       6
     759     768     828     831       6     756     759     768     771       3
     756     759    -768     771       4     747     756     759     762       5
     747     756     759     765       5     930     924     918     933       3
     930     924    -918     933       4     927     924     918     933       3
     927     924    -918     933       4     921     918     924     927       6
     921     918     924     930       6     921     918     933     936       5
     906     900     897     909       8     903     900     897     909       8
     894     891     897     900      11     894     891     897     909      11
     891     897     900     903       8     891     897     900     906       8
     888     885     882     912      12     888     885     891     894      13
     888     885     891     897      13     882     876     924     927       6
     882     876     924     930       6     882     885     891     894      13
     879     876     882     885       7     879     876     882     912       7
     879     876     924     918       6     879     876     924     927       6
     879     876     924     930       6     876     882     885     888      12
     876     924     918     921       6     873     867     918     921       3
     873     867    -918     921       4     873     876     924     927       3
     873     876    -924     927       4     873     876     924     930       3
     873     876    -924     930       4     870     867     873     876       5
     870     867     918     921       6     870     867     918     924       6
     870     867     918     933       3     870     867    -918     933       4
     867     873     876     879       5     867     918     924     927      24
     867     918     924     930      24     864     858     867     870       6
     864     858     867     873       3     864     858    -867     873       4
     864     858     867     918       6     861     858     867     870       6
     861     858     867     873       3     861     858    -867     873       4
     861     858     867     918       6     858     867     918     921       6
     855     858     867     870       3     855     858    -867     870       4
     846     855     858     861       5     846     855     858     864       5
    1020    1014    1008    1023       3    1020    1014   -1008    1023       4
    1017    1014    1008    1023       3    1017    1014   -1008    1023       4
    1011    1008    1014    1017       6    1011    1008    1014    1020       6
    1011    1008    1023    1026       5     996     990     987     999       8
     993     990     987     999       8     984     981     987     990      11
     984     981     987     999      11     981     987     990     993       8
     981     987     990     996       8     978     975     972    1002      12
     978     975     981     984      13     978     975     981     987      13
     972     966    1014    1017       6     972     966    1014    1020       6
     972     975     981     984      13     969     966     972     975       7
     969     966     972    1002       7     969     966    1014    1008       6
     969     966    1014    1017       6     969     966    1014    1020       6
     966     972     975     978      12     966    1014    1008    1011       6
     963     957    1008    1011       3     963     957   -1008    1011       4
     963     966    1014    1017       3     963     966   -1014    1017       4
     963     966    1014    1020       3     963     966   -1014    1020       4
     960     957     963     966       5     960     957    1008    1011       6
     960     957    1008    1014       6     960     957    1008    1023       3
     960     957   -1008    1023       4     957     963     966     969       5
     957    1008    1014    1017      24     957    1008    1014    1020      24
     954     948     957     960       6     954     948     957     963       3
     954     948    -957     963       4     954     948     957    1008       6
     951     948     957     960       6     951     948     957     963       3
     951     948    -957     963       4     951     948     957    1008       6
     948     957    1008    1011       6     945     948     957     960       3
     945     948    -957     960       4     936     945     948     951       5
     936     945     948     954       5    1119    1113    1107    1122       3
    1119    1113   -1107    1122       4    1116    1113    1107    1122       3
    1116    1113   -1107    1122       4    1113    1107    1122    1125       3
    1113    1107   -1122    1125      24    1110    1107    1113    1116       6
    1110    1107    1113    1119       6    1110    1107    1122    1125      25
    1098    1092    1089    1101       8    1095    1092    1089    1101       8
    1086    1083    1089    1092      26    1086    1083    1089    1101      26
    1083    1089    1092    1095       8    1083    1089    1092    1098       8
    1080    1077    1083    1086      28    1074    1077    1083    1086      28
    1068    1065    1062    1104      31    1068    1065    1071    1074      32
    1062    1056    1113    1116       6    1062    1056    1113    1119       6
    1059    1056    1062    1065       7    1059    1056    1062    1104       7
    1059    1056    1113    1107       6    1059    1056    1113    1116       6
    1059    1056    1113    1119       6    1056    1062    1065    1068      31
    1056    1113    1107    1110       6    1053    1047    1107    1110       3
    1053    1047   -1107    1110       4    1053    1056    1113    1116       3
    1053    1056   -1113    1116       4    1053    1056    1113    1119       3
    1053    1056   -1113    1119       4    1050    1047    1053    1056       5
    1050    1047    1107    1110       6    1050    1047    1107    1113       6
    1050    1047    1107    1122       3    1050    1047   -1107    1122       4
    1047    1053    1056    1059       5    1047    1107    1113    1116      24
    1047    1107    1113    1119      24    1047    1107    1122    1125       3
    1047    1107   -1122    1125      24    1044    1038    1047    1050       6
    1044    1038    1047    1053       3    1044    1038   -1047    1053       4
    1044    1038    1047    1107       6    1041    1038    1047    1050       6
    1041    1038    1047    1053       3    1041    1038   -1047    1053       4
    1041    1038    1047    1107       6    1038    1047    1107    1110       6
    1035    1038    1047    1050       3    1035    1038   -1047    1050       4
    1026    1035    1038    1041       5    1026    1035    1038    1044       5
      45      51     -48     -54      35      33      45     -39     -42      36
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     972     981    -975    -978      36    1089    1095   -1092   -1098      35
    1077    1089   -1083   -1086      35    1062    1071   -1065   -1068      36
%FLAG DIHEDRALS_WITHOUT_HYDROGEN                                                
%FORMAT(10I8)                                                                   
      81      84      93      96       1      81      84     -93      96       2
      72      66      81      84       5      66      81      84      87       2
      66      81      84      90       2      66      81      84      93       1
      66      81     -84      93       2      60      30      24      72       7
      48      45      57      60       9      45      57      60      63      10
      39      33      30      60      12      39      45     -57      60       9
      33      30      24      72       7      33      30      60      57      14
      33      30      60      63      14      33      39      45      48      11
      33      39     -45      57      11      30      24      72      66       6
      30      33      39      45      13      30      60     -57      45      10
      24      21     -15      66      15      24      21     -15      66      16
      24      30      33      39      12      24      30      60      57      14
      24      30      60      63      14      24      72      66      81       6
      21      15     -66      72       6      21      15      66      81      17
      21      15     -66      81      18      21      24      30      33      19
      21      24     -30      33       7      21      24      30      60       7
      21      24     -72      66       6      15      21      24      30      20
      15      21     -24      30      16      15      21     -24      72      15
      15      21     -24      72      16      15      66     -72      24      21
      15      66     -72      24      22      15      66     -72      24      23
      15      66      81      84       5       6      15      21      24      15
       6      15     -21      24      16       6      15      66      72      21
       6      15     -66      72      22       6      15     -66      72      23
       6      15      66      81       6       3       6      15      21      17
       3       6     -15      21      18       3       6      15      66       6
     180     183     192     195       1     180     183    -192     195       2
     171     165     180     183       5     165     180     183     186       2
     165     180     183     189       2     165     180     183     192       1
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     150     147     159     162       9     141     135     132     162      27
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     132     135     141     147      28     132     162    -159     147      30
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     114     111    -105     165      15     114     111    -105     165      16
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     111     114    -171     165       6     105     111     114     120      20
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     105     111    -114     171      16     105     165    -171     114      21
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     105     165     180     183       5      96     105     111     114      15
      96     105    -111     114      16      96     105     165     171      21
      96     105    -165     171      22      96     105    -165     171      23
      96     105     165     180       6      93      96     105     111      17
      93      96    -105     111      18      93      96     105     165       6
      90      84      93      96       2      87      84      93      96       2
      84      93      96     105       5     279     282     291     294       1
     279     282    -291     294       2     270     264     279     282       5
     264     279     282     285       2     264     279     282     288       2
     264     279     282     291       1     264     279    -282     291       2
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     240     234     231     261      27     240     246    -258     261       9
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     234     231     261     258      29     234     240     246     249      26
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     228     231     261     258      29     222     219     213     270       7
     222     219    -261     231      33     222     219     261     258      33
     222     228     231     234      11     222     228    -231     261      11
     219     213     270     264       6     219     222    -228     231      32
     219     261    -231     228      29     219     261     231     234      29
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     213     219     261     231      33     213     219     261     258      33
     213     270     264     279       6     210     204    -264     270       6
     210     204     264     279      17     210     204    -264     279      18
     210     213     219     222      19     210     213    -219     222       7
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     336     333     345     348       9     333     345     348     351      10
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     321     318     348     351      14     321     327     333     336      11
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     312     318     348     351      14     312     360     354     369       6
     309     303    -354     360       6     309     303     354     369      17
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     303     309    -312     360      16     303     354    -360     312      21
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     303     354     369     372       5     294     303     309     312      15
     294     303    -309     312      16     294     303     354     360      21
     294     303    -354     360      22     294     303    -354     360      23
     294     303     354     369       6     291     294     303     309      17
     291     294    -303     309      18     291     294     303     354       6
     288     282     291     294       2     285     282     291     294       2
     282     291     294     303       5     459     462     471     474       1
     459     462    -471     474       2     450     444     459     462       5
     444     459     462     465       2     444     459     462     468       2
     444     459     462     471       1     444     459    -462     471       2
     438     408     402     450       7     426     423     435     438       9
     423     435     438     441      10     417     411     408     438      12
     417     423    -435     438       9     411     408     402     450       7
     411     408     438     435      14     411     408     438     441      14
     411     417     423     426      11     411     417    -423     435      11
     408     402     450     444       6     408     411     417     423      13
     408     438    -435     423      10     402     399    -393     444      15
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     402     408     438     435      14     402     408     438     441      14
     402     450     444     459       6     399     393    -444     450       6
     399     393     444     459      17     399     393    -444     459      18
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     399     402     408     438       7     399     402    -450     444       6
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     393     444    -450     402      21     393     444    -450     402      22
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     384     393     399     402      15     384     393    -399     402      16
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     381     384     393     444       6     378     372     381     384       2
     375     372     381     384       2     372     381     384     393       5
     540     498     492     549       7     528     525     537     540       9
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     474     483     543     558       6     471     474     483     489      17
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     468     462     471     474       2     465     462     471     474       2
     462     471     474     483       5     645     648     657     660       1
     645     648    -657     660       2     636     630     645     648       5
     630     645     648     651       2     630     645     648     654       2
     630     645     648     657       1     630     645    -648     657       2
     624     594     588     636       7     612     609     621     624       9
     609     621     624     627      10     603     597     594     624      12
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     588     594     624     621      14     588     594     624     627      14
     588     636     630     645       6     585     579    -630     636       6
     585     579     630     645      17     585     579    -630     645      18
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     579     585     588     594      20     579     585    -588     594      16
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     567     570     579     585      17     567     570    -579     585      18
     567     570     579     630       6     744     747     756     759       1
     744     747    -756     759       2     735     729     744     747       5
     729     744     747     750       2     729     744     747     753       2
     729     744     747     756       1     729     744    -747     756       2
     726     684     678     735       7     714     711     723     726       9
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     684     678     735     729       6     684     687    -693     696      32
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     669     675     678     684      20     669     675    -678     684      16
     669     675    -678     735      15     669     675    -678     735      16
     669     729    -735     678      21     669     729    -735     678      22
     669     729    -735     678      23     669     729     744     747       5
     660     669     675     678      15     660     669    -675     678      16
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     660     669    -729     735      23     660     669     729     744       6
     657     660     669     675      17     657     660    -669     675      18
     657     660     669     729       6     654     648     657     660       2
     651     648     657     660       2     648     657     660     669       5
     843     846     855     858       1     843     846    -855     858       2
     834     828     843     846       5     828     843     846     849       2
     828     843     846     852       2     828     843     846     855       1
     828     843    -846     855       2     825     783     777     834       7
     813     810     822     825       9     804     798     795     825      27
     804     810    -822     825       9     801     798     795     825      27
     801     798     804     810      28     798     795     825     822      29
     798     804     810     813      26     798     804    -810     822      26
     795     798     804     810      28     795     825    -822     810      30
     792     786    -783     825      31     792     795     798     801      27
     792     795     798     804      27     792     795     825     822      29
     786     783     777     834       7     786     783    -825     795      33
     786     783     825     822      33     786     792     795     798      11
     786     792    -795     825      11     783     777     834     828       6
     783     786    -792     795      32     783     825    -795     792      29
     783     825     795     798      29     783     825     822     810      30
     777     774    -768     828      15     777     774    -768     828      16
     777     783     786     792      31     777     783     825     795      33
     777     783     825     822      33     777     834     828     843       6
     774     768    -828     834       6     774     768     828     843      17
     774     768    -828     843      18     774     777     783     786      19
     774     777    -783     786       7     774     777     783     825       7
     774     777    -834     828       6     768     774     777     783      20
     768     774    -777     783      16     768     774    -777     834      15
     768     774    -777     834      16     768     828    -834     777      21
     768     828    -834     777      22     768     828    -834     777      23
     768     828     843     846       5     759     768     774     777      15
     759     768    -774     777      16     759     768     828     834      21
     759     768    -828     834      22     759     768    -828     834      23
     759     768     828     843       6     756     759     768     774      17
     756     759    -768     774      18     756     759     768     828       6
     753     747     756     759       2     750     747     756     759       2
     747     756     759     768       5     933     936     945     948       1
     933     936    -945     948       2     924     918     933     936       5
     918     933     936     939       2     918     933     936     942       2
     918     933     936     945       1     918     933    -936     945       2
     912     882     876     924       7     900     897     909     912       9
     897     909     912     915      10     891     885     882     912      12
     891     897    -909     912       9     885     882     876     924       7
     885     882     912     909      14     885     882     912     915      14
     885     891     897     900      11     885     891    -897     909      11
     882     876     924     918       6     882     885     891     897      13
     882     912    -909     897      10     876     873    -867     918      15
     876     873    -867     918      16     876     882     885     891      12
     876     882     912     909      14     876     882     912     915      14
     876     924     918     933       6     873     867    -918     924       6
     873     867     918     933      17     873     867    -918     933      18
     873     876     882     885      19     873     876    -882     885       7
     873     876     882     912       7     873     876    -924     918       6
     867     873     876     882      20     867     873    -876     882      16
     867     873    -876     924      15     867     873    -876     924      16
     867     918    -924     876      21     867     918    -924     876      22
     867     918    -924     876      23     867     918     933     936       5
     858     867     873     876      15     858     867    -873     876      16
     858     867     918     924      21     858     867    -918     924      22
     858     867    -918     924      23     858     867     918     933       6
     855     858     867     873      17     855     858    -867     873      18
     855     858     867     918       6     852     846     855     858       2
     849     846     855     858       2     846     855     858     867       5
    1023    1026    1035    1038       1    1023    1026   -1035    1038       2
    1014    1008    1023    1026       5    1008    1023    1026    1029       2
    1008    1023    1026    1032       2    1008    1023    1026    1035       1
    1008    1023   -1026    1035       2    1002     972     966    1014       7
     990     987     999    1002       9     987     999    1002    1005      10
     981     975     972    1002      12     981     987    -999    1002       9
     975     972     966    1014       7     975     972    1002     999      14
     975     972    1002    1005      14     975     981     987     990      11
     975     981    -987     999      11     972     966    1014    1008       6
     972     975     981     987      13     972    1002    -999     987      10
     966     963    -957    1008      15     966     963    -957    1008      16
     966     972     975     981      12     966     972    1002     999      14
     966     972    1002    1005      14     966    1014    1008    1023       6
     963     957   -1008    1014       6     963     957    1008    1023      17
     963     957   -1008    1023      18     963     966     972     975      19
     963     966    -972     975       7     963     966     972    1002       7
     963     966   -1014    1008       6     957     963     966     972      20
     957     963    -966     972      16     957     963    -966    1014      15
     957     963    -966    1014      16     957    1008   -1014     966      21
     957    1008   -1014     966      22     957    1008   -1014     966      23
     957    1008    1023    1026       5     948     957     963     966      15
     948     957    -963     966      16     948     957    1008    1014      21
     948     957   -1008    1014      22     948     957   -1008    1014      23
     948     957    1008    1023       6     945     948     957     963      17
     945     948    -957     963      18     945     948     957    1008       6
     942     936     945     948       2     939     936     945     948       2
     936     945     948     957       5    1104    1062    1056    1113       7
    1092    1089    1101    1104       9    1083    1077    1074    1104      27
    1083    1089   -1101    1104       9    1080    1077    1074    1104      27
    1080    1077    1083    1089      28    1077    1074    1104    1101      29
    1077    1083    1089    1092      26    1077    1083   -1089    1101      26
    1074    1077    1083    1089      28    1074    1104   -1101    1089      30
    1071    1065   -1062    1104      31    1071    1074    1077    1080      27
    1071    1074    1077    1083      27    1071    1074    1104    1101      29
    1065    1062    1056    1113       7    1065    1062   -1104    1074      33
    1065    1062    1104    1101      33    1065    1071    1074    1077      11
    1065    1071   -1074    1104      11    1062    1056    1113    1107       6
    1062    1065   -1071    1074      32    1062    1104   -1074    1071      29
    1062    1104    1074    1077      29    1062    1104    1101    1089      30
    1056    1053   -1047    1107      15    1056    1053   -1047    1107      16
    1056    1062    1065    1071      31    1056    1062    1104    1074      33
    1056    1062    1104    1101      33    1056    1113    1107    1122       6
    1053    1047   -1107    1113       6    1053    1047    1107    1122      17
    1053    1047   -1107    1122      18    1053    1056    1062    1065      19
    1053    1056   -1062    1065       7    1053    1056    1062    1104       7
    1053    1056   -1113    1107       6    1047    1053    1056    1062      20
    1047    1053   -1056    1062      16    1047    1053   -1056    1113      15
    1047    1053   -1056    1113      16    1047    1107   -1113    1056      21
    1047    1107   -1113    1056      22    1047    1107   -1113    1056      23
    1038    1047    1053    1056      15    1038    1047   -1053    1056      16
    1038    1047    1107    1113      21    1038    1047   -1107    1113      22
    1038    1047   -1107    1113      23    1038    1047    1107    1122       6
    1035    1038    1047    1053      17    1035    1038   -1047    1053      18
    1035    1038    1047    1107       6    1032    1026    1035    1038       2
    1029    1026    1035    1038       2    1026    1035    1038    1047       5
      30      57     -60     -63      34      39      48     -45     -57      36
      60      33     -30     -24      35     150     141    -147    -159      36
     132     141    -135    -138      34     162     123    -120    -114      35
     249     240    -246    -258      36     231     240    -234    -237      34
     261     222    -219    -213      35     318     345    -348    -351      34
     327     336    -333    -345      36     348     321    -318    -312      35
     408     435    -438    -441      34     417     426    -423    -435      36
     438     411    -408    -402      35     528     519    -525    -537      36
     510     519    -513    -516      34     540     501    -498    -492      35
     594     621    -624    -627      34     603     612    -609    -621      36
     624     597    -594    -588      35     714     705    -711    -723      36
     696     705    -699    -702      34     726     687    -684    -678      35
     813     804    -810    -822      36     795     804    -798    -801      34
     825     786    -783    -777      35     882     909    -912    -915      34
     891     900    -897    -909      36     912     885    -882    -876      35
     972     999   -1002   -1005      34     981     990    -987    -999      36
    1002     975    -972    -966      35    1092    1083   -1089   -1101      36
    1074    1083   -1077   -1080      34    1104    1065   -1062   -1056      35
%FLAG EXCLUDED_ATOMS_LIST                                                       
%FORMAT(10I8)                                                                   
       2       3       4       5       6       3       4       5       6       7
       8      23       4       5       6       7       8       9      23      24
      25      28       5       6       7       8      23       6       7       8
      23       7       8       9      10      11      23      24      25      26
      27      28      29       8       9      23      24      25      28       9
      10      11      12      21      23      24      25      26      27      28
      10      11      12      13      14      20      21      22      23      24
      25      26      27      28      11      12      21      23      25      26
      27      12      13      14      15      16      20      21      22      23
      25      26      27      13      14      15      16      17      20      21
      22      25      14      15      16      21      15      16      17      18
      19      20      21      16      17      20      17      18      19      20
      21      22      18      19      20      21      19      20      20      21
      22      22      25       0      24      25      26      27      28      29
      30      31      32      25      26      27      28      29      26      27
      28      29      27      28      28      29      30      31      32      33
      30      31      32      33      34      35      36      31      32      33
      32      33      33      34      35      36      37      38      56      34
      35      36      37      38      39      56      57      58      61      35
      36      37      38      56      36      37      38      56      37      38
      39      40      41      56      57      58      59      60      61      62
      38      39      56      57      58      61      39      40      41      42
      55      56      57      58      59      60      61      40      41      42
      43      44      45      54      55      56      57      58      59      60
      61      41      42      55      56      58      59      60      42      43
      44      45      46      50      54      55      56      58      59      60
      43      44      45      46      54      55      58      44      45      55
      45      46      47      48      54      55      46      47      48      49
      50      54      55      47      48      49      50      51      54      55
      48      49      50      55      49      50      51      52      53      54
      55      50      51      54      51      52      53      54      55      52
      53      54      55      53      54      54      55      58      57      58
      59      60      61      62      63      64      65      58      59      60
      61      62      59      60      61      62      60      61      61      62
      63      64      65      66      63      64      65      66      67      68
      69      64      65      66      65      66      66      67      68      69
      70      71      89      67      68      69      70      71      72      89
      90      91      94      68      69      70      71      89      69      70
      71      89      70      71      72      73      74      89      90      91
      92      93      94      95      71      72      89      90      91      94
      72      73      74      75      88      89      90      91      92      93
      94      73      74      75      76      77      78      87      88      89
      90      91      92      93      94      74      75      88      89      91
      92      93      75      76      77      78      79      83      87      88
      89      91      92      93      76      77      78      79      87      88
      91      77      78      88      78      79      80      81      87      88
      79      80      81      82      83      87      88      80      81      82
      83      84      87      88      81      82      83      88      82      83
      84      85      86      87      88      83      84      87      84      85
      86      87      88      85      86      87      88      86      87      87
      88      91      90      91      92      93      94      95      96      97
      98      91      92      93      94      95      92      93      94      95
      93      94      94      95      96      97      98      99      96      97
      98      99     100     101     102      97      98      99      98      99
      99     100     101     102     103     104     119     100     101     102
     103     104     105     119     120     121     124     101     102     103
     104     119     102     103     104     119     103     104     105     106
     107     119     120     121     122     123     124     125     104     105
     119     120     121     124     105     106     107     108     117     119
     120     121     122     123     124     106     107     108     109     110
     116     117     118     119     120     121     122     123     124     107
     108     117     119     121     122     123     108     109     110     111
     112     116     117     118     119     121     122     123     109     110
     111     112     113     116     117     118     121     110     111     112
     117     111     112     113     114     115     116     117     112     113
     116     113     114     115     116     117     118     114     115     116
     117     115     116     116     117     118     118     121       0     120
     121     122     123     124     125     126     127     128     121     122
     123     124     125     122     123     124     125     123     124     124
     125     126     127     128     129     126     127     128     129     130
     131     132     127     128     129     128     129     129     130     131
     132     133     134     149     130     131     132     133     134     135
     149     150     151     154     131     132     133     134     149     132
     133     134     149     133     134     135     136     137     149     150
     151     152     153     154     155     134     135     149     150     151
     154     135     136     137     138     147     149     150     151     152
     153     154     136     137     138     139     140     146     147     148
     149     150     151     152     153     154     137     138     147     149
     151     152     153     138     139     140     141     142     146     147
     148     149     151     152     153     139     140     141     142     143
     146     147     148     151     140     141     142     147     141     142
     143     144     145     146     147     142     143     146     143     144
     145     146     147     148     144     145     146     147     145     146
     146     147     148     148     151       0     150     151     152     153
     154     155     156     157     158     151     152     153     154     155
     152     153     154     155     153     154     154     155     156     157
     158     159     156     157     158     159     160     161     162     157
     158     159     158     159     159     160     161     162     163     164
     182     160     161     162     163     164     165     182     183     184
     187     161     162     163     164     182     162     163     164     182
     163     164     165     166     167     182     183     184     185     186
     187     188     164     165     182     183     184     187     165     166
     167     168     181     182     183     184     185     186     187     166
     167     168     169     170     171     180     181     182     183     184
     185     186     187     167     168     181     182     184     185     186
     168     169     170     171     172     176     180     181     182     184
     185     186     169     170     171     172     180     181     184     170
     171     181     171     172     173     174     180     181     172     173
     174     175     176     180     181     173     174     175     176     177
     180     181     174     175     176     181     175     176     177     178
     179     180     181     176     177     180     177     178     179     180
     181     178     179     180     181     179     180     180     181     184
     183     184     185     186     187     188     184     185     186     187
     188     185     186     187     188     186     187     187     188       0
     190     191     192     193     194     191     192     193     194     195
     196     211     192     193     194     195     196     197     211     212
     213     216     193     194     195     196     211     194     195     196
     211     195     196     197     198     199     211     212     213     214
     215     216     217     196     197     211     212     213     216     197
     198     199     200     209     211     212     213     214     215     216
     198     199     200     201     202     208     209     210     211     212
     213     214     215     216     199     200     209     211     213     214
     215     200     201     202     203     204     208     209     210     211
     213     214     215     201     202     203     204     205     208     209
     210     213     202     203     204     209     203     204     205     206
     207     208     209     204     205     208     205     206     207     208
     209     210     206     207     208     209     207     208     208     209
     210     210     213       0     212     213     214     215     216     217
     218     219     220     213     214     215     216     217     214     215
     216     217     215     216     216     217     218     219     220     221
     218     219     220     221     222     223     224     219     220     221
     220     221     221     222     223     224     225     226     244     222
     223     224     225     226     227     244     245     246     249     223
     224     225     226     244     224     225     226     244     225     226
     227     228     229     244     245     246     247     248     249     250
     226     227     244     245     246     249     227     228     229     230
     243     244     245     246     247     248     249     228     229     230
     231     232     233     242     243     244     245     246     247     248
     249     229     230     243     244     246     247     248     230     231
     232     233     234     238     242     243     244     246     247     248
     231     232     233     234     242     243     246     232     233     243
     233     234     235     236     242     243     234     235     236     237
     238     242     243     235     236     237     238     239     242     243
     236     237     238     243     237     238     239     240     241     242
     243     238     239     242     239     240     241     242     243     240
     241     242     243     241     242     242     243     246     245     246
     247     248     249     250     251     252     253     246     247     248
     249     250     247     248     249     250     248     249     249     250
     251     252     253     254     251     252     253     254     255     256
     257     252     253     254     253     254     254     255     256     257
     258     259     277     255     256     257     258     259     260     277
     278     279     282     256     257     258     259     277     257     258
     259     277     258     259     260     261     262     277     278     279
     280     281     282     283     259     260     277     278     279     282
     260     261     262     263     276     277     278     279     280     281
     282     261     262     263     264     265     266     275     276     277
     278     279     280     281     282     262     263     276     277     279
     280     281     263     264     265     266     267     271     275     276
     277     279     280     281     264     265     266     267     275     276
     279     265     266     276     266     267     268     269     275     276
     267     268     269     270     271     275     276     268     269     270
     271     272     275     276     269     270     271     276     270     271
     272     273     274     275     276     271     272     275     272     273
     274     275     276     273     274     275     276     274     275     275
     276     279     278     279     280     281     282     283     284     285
     286     279     280     281     282     283     280     281     282     283
     281     282     282     283     284     285     286     287     284     285
     286     287     288     289     290     285     286     287     286     287
     287     288     289     290     291     292     307     288     289     290
     291     292     293     307     308     309     312     289     290     291
     292     307     290     291     292     307     291     292     293     294
     295     307     308     309     310     311     312     313     292     293
     307     308     309     312     293     294     295     296     305     307
     308     309     310     311     312     294     295     296     297     298
     304     305     306     307     308     309     310     311     312     295
     296     305     307     309     310     311     296     297     298     299
     300     304     305     306     307     309     310     311     297     298
     299     300     301     304     305     306     309     298     299     300
     305     299     300     301     302     303     304     305     300     301
     304     301     302     303     304     305     306     302     303     304
     305     303     304     304     305     306     306     309       0     308
     309     310     311     312     313     314     315     316     309     310
     311     312     313     310     311     312     313     311     312     312
     313     314     315     316     317     314     315     316     317     318
     319     320     315     316     317     316     317     317     318     319
     320     321     322     337     318     319     320     321     322     323
     337     338     339     342     319     320     321     322     337     320
     321     322     337     321     322     323     324     325     337     338
     339     340     341     342     343     322     323     337     338     339
     342     323     324     325     326     335     337     338     339     340
     341     342     324     325     326     327     328     334     335     336
     337     338     339     340     341     342     325     326     335     337
     339     340     341     326     327     328     329     330     334     335
     336     337     339     340     341     327     328     329     330     331
     334     335     336     339     328     329     330     335     329     330
     331     332     333     334     335     330     331     334     331     332
     333     334     335     336     332     333     334     335     333     334
     334     335     336     336     339       0     338     339     340     341
     342     343     344     345     346     339     340     341     342     343
     340     341     342     343     341     342     342     343     344     345
     346     347     344     345     346     347     348     349     350     345
     346     347     346     347     347     348     349     350     351     352
     370     348     349     350     351     352     353     370     371     372
     375     349     350     351     352     370     350     351     352     370
     351     352     353     354     355     370     371     372     373     374
     375     376     352     353     370     371     372     375     353     354
     355     356     369     370     371     372     373     374     375     354
     355     356     357     358     359     368     369     370     371     372
     373     374     375     355     356     369     370     372     373     374
     356     357     358     359     360     364     368     369     370     372
     373     374     357     358     359     360     368     369     372     358
     359     369     359     360     361     362     368     369     360     361
     362     363     364     368     369     361     362     363     364     365
     368     369     362     363     364     369     363     364     365     366
     367     368     369     364     365     368     365     366     367     368
     369     366     367     368     369     367     368     368     369     372
     371     372     373     374     375     376     372     373     374     375
     376     373     374     375     376     374     375     375     376       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  CT  H1  H1  CT  H1  OS  CT  H2  N*  CM  H4  CM  HA  CA  N2  H   H   NC  
C   O   CT  H1  CT  HC  HC  OS  P   O2  O2  OS  CT  H1  H1  CT  H1  OS  CT  H2  
N*  CK  H5  NB  CB  C   O   NA  H   CA  N2  H   H   NC  CB  CT  H1  CT  HC  HC  
OS  P   O2  O2  OS  CT  H1  H1  CT  H1  OS  CT  H2  N*  CK  H5  NB  CB  C   O   
NA  H   CA  N2  H   H   NC  CB  CT  H1  CT  HC  HC  OS  P   O2  O2  OS  CT  H1  
H1  CT  H1  OS  CT  H2  N*  CM  H4  CM  HA  CA  N2  H   H   NC  C   O   CT  H1  
CT  HC  HC  OS  P   O2  O2  OS  CT  H1  H1  CT  H1  OS  CT  H2  N*  CM  H4  CM  
HA  CA  N2  H   H   NC  C   O   CT  H1  CT  HC  HC  OS  P   O2  O2  OS  CT  H1  
H1  CT  H1  OS  CT  H2  N*  CK  H5  NB  CB  C   O   NA  H   CA  N2  H   H   NC  
CB  CT  H1  CT  HC  HC  OH  HO  HO  OH  CT  H1  H1  CT  H1  OS  CT  H2  N*  CM  
H4  CM  HA  CA  N2  H   H   NC  C   O   CT  H1  CT  HC  HC  OS  P   O2  O2  OS  
CT  H1  H1  CT  H1  OS  CT  H2  N*  CK  H5  NB  CB  C   O   NA  H   CA  N2  H   
H   NC  CB  CT  H1  CT  HC  HC  OS  P   O2  O2  OS  CT  H1  H1  CT  H1  OS  CT  
H2  N*  CK  H5  NB  CB  C   O   NA  H   CA  N2  H   H   NC  CB  CT  H1  CT  HC  
HC  OS  P   O2  O2  OS  CT  H1  H1  CT  H1  OS  CT  H2  N*  CM  H4  CM  HA  CA  
N2  H   H   NC  C   O   CT  H1  CT  HC  HC  OS  P   O2  O2  OS  CT  H1  H1  CT  
H1  OS  CT  H2  N*  CM  H4  CM  HA  CA  N2  H   H   NC  C   O   CT  H1  CT  HC  
HC  OS  P   O2  O2  OS  CT  H1  H1  CT  H1  OS  CT  H2  N*  CK  H5  NB  CB  C   
O   NA  H   CA  N2  H   H   NC  CB  CT  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   E   B   B   E   E   S   
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   S   E   B   B   E   E   S   B   E   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   E   S   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   M   M   M   E   E   M   E   S   3   E   B   S   
E   S   E   B   B   E   E   S   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   S   E   B   
B   E   E   S   B   E   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   E   S   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   
%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
%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
%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  1.30000000E+00
  1.70000000E+00  1.55000000E+00  1.30000000E+00  1.30000000E+00  1.55000000E+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  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  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
  1.30000000E+00  1.70000000E+00  1.55000000E+00  1.30000000E+00  1.30000000E+00
  1.55000000E+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
  1.30000000E+00  1.70000000E+00  1.55000000E+00  1.30000000E+00  1.30000000E+00
  1.55000000E+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  8.00000000E-01  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  1.30000000E+00  1.70000000E+00  1.55000000E+00
  1.30000000E+00  1.30000000E+00  1.55000000E+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  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  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  1.30000000E+00  1.70000000E+00
  1.55000000E+00  1.30000000E+00  1.30000000E+00  1.55000000E+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  1.30000000E+00  1.70000000E+00
  1.55000000E+00  1.30000000E+00  1.30000000E+00  1.55000000E+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
  8.00000000E-01
%FLAG SCREEN                                                                    
%FORMAT(5E16.8)                                                                 
  8.50000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01  8.50000000E-01
  7.20000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  7.90000000E-01  7.20000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  7.20000000E-01  7.90000000E-01  8.50000000E-01  8.50000000E-01  7.90000000E-01
  7.20000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01  7.20000000E-01
  8.50000000E-01  8.50000000E-01  8.50000000E-01  8.60000000E-01  8.50000000E-01
  8.50000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01  8.50000000E-01
  7.20000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  7.90000000E-01  7.20000000E-01  8.50000000E-01  7.90000000E-01  7.20000000E-01
  7.20000000E-01  8.50000000E-01  7.90000000E-01  8.50000000E-01  7.20000000E-01
  7.90000000E-01  8.50000000E-01  8.50000000E-01  7.90000000E-01  7.20000000E-01
  7.20000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01  8.50000000E-01
  8.50000000E-01  8.60000000E-01  8.50000000E-01  8.50000000E-01  8.50000000E-01
  7.20000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  8.50000000E-01  7.20000000E-01  8.50000000E-01  7.90000000E-01  7.20000000E-01
  8.50000000E-01  7.90000000E-01  7.20000000E-01  7.20000000E-01  8.50000000E-01
  7.90000000E-01  8.50000000E-01  7.20000000E-01  7.90000000E-01  8.50000000E-01
  8.50000000E-01  7.90000000E-01  7.20000000E-01  7.20000000E-01  8.50000000E-01
  7.20000000E-01  8.50000000E-01  8.50000000E-01  8.50000000E-01  8.60000000E-01
  8.50000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  8.50000000E-01  7.20000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01
  8.50000000E-01  7.90000000E-01  7.20000000E-01  8.50000000E-01  7.20000000E-01
  8.50000000E-01  7.20000000E-01  7.90000000E-01  8.50000000E-01  8.50000000E-01
  7.90000000E-01  7.20000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  7.20000000E-01  8.50000000E-01  8.50000000E-01  8.50000000E-01  8.60000000E-01
  8.50000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  8.50000000E-01  7.20000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01
  8.50000000E-01  7.90000000E-01  7.20000000E-01  8.50000000E-01  7.20000000E-01
  8.50000000E-01  7.20000000E-01  7.90000000E-01  8.50000000E-01  8.50000000E-01
  7.90000000E-01  7.20000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  7.20000000E-01  8.50000000E-01  8.50000000E-01  8.50000000E-01  8.60000000E-01
  8.50000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  8.50000000E-01  7.20000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01
  8.50000000E-01  7.90000000E-01  7.20000000E-01  8.50000000E-01  7.90000000E-01
  7.20000000E-01  7.20000000E-01  8.50000000E-01  7.90000000E-01  8.50000000E-01
  7.20000000E-01  7.90000000E-01  8.50000000E-01  8.50000000E-01  7.90000000E-01
  7.20000000E-01  7.20000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  8.50000000E-01  8.50000000E-01  8.50000000E-01  8.50000000E-01  8.50000000E-01
  7.20000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  8.50000000E-01  7.20000000E-01  8.50000000E-01  7.90000000E-01  7.20000000E-01
  8.50000000E-01  7.20000000E-01  8.50000000E-01  7.20000000E-01  7.90000000E-01
  8.50000000E-01  8.50000000E-01  7.90000000E-01  7.20000000E-01  8.50000000E-01
  7.20000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01  8.50000000E-01
  8.50000000E-01  8.60000000E-01  8.50000000E-01  8.50000000E-01  8.50000000E-01
  7.20000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  8.50000000E-01  7.20000000E-01  8.50000000E-01  7.90000000E-01  7.20000000E-01
  8.50000000E-01  7.90000000E-01  7.20000000E-01  7.20000000E-01  8.50000000E-01
  7.90000000E-01  8.50000000E-01  7.20000000E-01  7.90000000E-01  8.50000000E-01
  8.50000000E-01  7.90000000E-01  7.20000000E-01  7.20000000E-01  8.50000000E-01
  7.20000000E-01  8.50000000E-01  8.50000000E-01  8.50000000E-01  8.60000000E-01
  8.50000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  8.50000000E-01  7.20000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01
  8.50000000E-01  7.90000000E-01  7.20000000E-01  8.50000000E-01  7.90000000E-01
  7.20000000E-01  7.20000000E-01  8.50000000E-01  7.90000000E-01  8.50000000E-01
  7.20000000E-01  7.90000000E-01  8.50000000E-01  8.50000000E-01  7.90000000E-01
  7.20000000E-01  7.20000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  8.50000000E-01  8.50000000E-01  8.60000000E-01  8.50000000E-01  8.50000000E-01
  8.50000000E-01  7.20000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01
  8.50000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01  7.90000000E-01
  7.20000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01  7.20000000E-01
  7.90000000E-01  8.50000000E-01  8.50000000E-01  7.90000000E-01  7.20000000E-01
  8.50000000E-01  7.20000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  8.50000000E-01  8.50000000E-01  8.60000000E-01  8.50000000E-01  8.50000000E-01
  8.50000000E-01  7.20000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01
  8.50000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01  7.90000000E-01
  7.20000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01  7.20000000E-01
  7.90000000E-01  8.50000000E-01  8.50000000E-01  7.90000000E-01  7.20000000E-01
  8.50000000E-01  7.20000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01
  8.50000000E-01  8.50000000E-01  8.60000000E-01  8.50000000E-01  8.50000000E-01
  8.50000000E-01  7.20000000E-01  8.50000000E-01  8.50000000E-01  7.20000000E-01
  8.50000000E-01  8.50000000E-01  7.20000000E-01  8.50000000E-01  7.90000000E-01
  7.20000000E-01  8.50000000E-01  7.90000000E-01  7.20000000E-01  7.20000000E-01
  8.50000000E-01  7.90000000E-01  8.50000000E-01  7.20000000E-01  7.90000000E-01
  8.50000000E-01  8.50000000E-01  7.90000000E-01  7.20000000E-01  7.20000000E-01
  8.50000000E-01  7.20000000E-01  8.50000000E-01  8.50000000E-01  8.50000000E-01
  8.50000000E-01
