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0.221E-02 0.444E-02 DAV: 19 -0.349267953227E+03 0.72557E-05 -0.52185E-05 7048 0.163E-02 16 F= -.34926795E+03 E0= -.34924351E+03 d E =-.148620E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.349270907025E+03 -0.29465E-02 -0.43546E+00 10720 0.421E+00 0.119E+00 DAV: 2 -0.349682005334E+03 -0.41110E+00 -0.19775E+00 17872 0.195E+00 0.893E+00 DAV: 3 -0.349232017390E+03 0.44999E+00 -0.16124E+00 16448 0.187E+00 0.134E+00 DAV: 4 -0.349278466613E+03 -0.46449E-01 -0.11917E-01 12264 0.718E-01 0.112E+00 DAV: 5 -0.349277788420E+03 0.67819E-03 -0.51618E-02 13888 0.497E-01 0.646E-01 DAV: 6 -0.349278345190E+03 -0.55677E-03 -0.22469E-02 13496 0.282E-01 0.556E-01 DAV: 7 -0.349277380575E+03 0.96461E-03 -0.95439E-03 13216 0.168E-01 0.269E-01 DAV: 8 -0.349277542108E+03 -0.16153E-03 -0.35587E-03 12952 0.981E-02 0.222E-01 DAV: 9 -0.349277517583E+03 0.24525E-04 -0.16617E-03 12744 0.919E-02 0.174E-01 DAV: 10 -0.349277448194E+03 0.69389E-04 -0.10571E-03 13048 0.751E-02 0.128E-01 DAV: 11 -0.349277488356E+03 -0.40161E-04 -0.87649E-04 13064 0.662E-02 0.136E-01 DAV: 12 -0.349277396882E+03 0.91473E-04 -0.46173E-04 12536 0.462E-02 0.517E-02 DAV: 13 -0.349277410028E+03 -0.13146E-04 -0.11620E-04 9032 0.250E-02 0.400E-02 DAV: 14 -0.349277405652E+03 0.43764E-05 -0.53246E-05 6880 0.165E-02 17 F= -.34927741E+03 E0= -.34925312E+03 d E =-.158073E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.349333394500E+03 -0.55984E-01 -0.42862E+01 10720 0.129E+01 0.322E+00 DAV: 2 -0.351899579378E+03 -0.25662E+01 -0.83914E+00 17552 0.552E+00 0.192E+01 DAV: 3 -0.349373137105E+03 0.25264E+01 -0.12132E+01 16056 0.427E+00 0.469E+00 DAV: 4 -0.349394986890E+03 -0.21850E-01 -0.66196E-01 14640 0.200E+00 0.253E+00 DAV: 5 -0.349426264104E+03 -0.31277E-01 -0.47418E-01 13952 0.146E+00 0.247E+00 DAV: 6 -0.349405135565E+03 0.21129E-01 -0.20146E-01 14328 0.984E-01 0.140E+00 DAV: 7 -0.349401824531E+03 0.33110E-02 -0.69743E-02 13008 0.420E-01 0.633E-01 DAV: 8 -0.349405855828E+03 -0.40313E-02 -0.30413E-02 14128 0.317E-01 0.915E-01 DAV: 9 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ncg rms rms(c) DAV: 1 -0.349402021717E+03 0.21454E-03 -0.10590E+01 10736 0.643E+00 0.166E+00 DAV: 2 -0.350242482289E+03 -0.84046E+00 -0.34255E+00 17704 0.282E+00 0.142E+01 DAV: 3 -0.349339962749E+03 0.90252E+00 -0.59438E+00 16496 0.244E+00 0.189E+00 DAV: 4 -0.349419026983E+03 -0.79064E-01 -0.19878E-01 13248 0.100E+00 0.164E+00 DAV: 5 -0.349420441420E+03 -0.14144E-02 -0.99434E-02 13992 0.745E-01 0.104E+00 DAV: 6 -0.349422146444E+03 -0.17050E-02 -0.56948E-02 14320 0.494E-01 0.102E+00 DAV: 7 -0.349417662737E+03 0.44837E-02 -0.26606E-02 12964 0.267E-01 0.328E-01 DAV: 8 -0.349419178009E+03 -0.15153E-02 -0.70488E-03 12832 0.157E-01 0.402E-01 DAV: 9 -0.349418817472E+03 0.36054E-03 -0.66018E-03 14352 0.130E-01 0.320E-01 DAV: 10 -0.349418641500E+03 0.17597E-03 -0.36998E-03 13328 0.119E-01 0.235E-01 DAV: 11 -0.349418576455E+03 0.65045E-04 -0.23257E-03 12888 0.960E-02 0.200E-01 DAV: 12 -0.349418402341E+03 0.17411E-03 -0.10669E-03 13792 0.681E-02 0.101E-01 DAV: 13 -0.349418402060E+03 0.28150E-06 -0.29525E-04 11808 0.442E-02 0.790E-02 DAV: 14 -0.349418382835E+03 0.19224E-04 -0.13847E-04 10408 0.262E-02 0.600E-02 DAV: 15 -0.349418377130E+03 0.57049E-05 -0.80526E-05 7448 0.197E-02 19 F= -.34941838E+03 E0= -.34939482E+03 d E =-.140971E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.349408991659E+03 0.93912E-02 -0.54315E+01 10720 0.143E+01 0.241E+00 DAV: 2 -0.350965820498E+03 -0.15568E+01 -0.62247E+00 15112 0.452E+00 0.183E+01 DAV: 3 -0.349424664491E+03 0.15412E+01 -0.95909E+00 14600 0.343E+00 0.291E+00 DAV: 4 -0.349536815070E+03 -0.11215E+00 -0.49798E-01 14712 0.154E+00 0.276E+00 DAV: 5 -0.349534003166E+03 0.28119E-02 -0.33826E-01 14064 0.119E+00 0.197E+00 DAV: 6 -0.349533966814E+03 0.36352E-04 -0.18451E-01 14736 0.766E-01 0.166E+00 DAV: 7 -0.349522312494E+03 0.11654E-01 -0.78736E-02 14296 0.528E-01 0.586E-01 DAV: 8 -0.349528282571E+03 -0.59701E-02 -0.32035E-02 13496 0.352E-01 0.925E-01 DAV: 9 -0.349524752154E+03 0.35304E-02 -0.31975E-02 15360 0.295E-01 0.569E-01 DAV: 10 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-.35020782E+03 d E =-.100299E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.350243280134E+03 -0.16174E-01 -0.13362E+01 10824 0.758E+00 0.899E-01 DAV: 2 -0.350344443259E+03 -0.10116E+00 -0.75838E-01 13496 0.179E+00 0.378E+00 DAV: 3 -0.350267644154E+03 0.76799E-01 -0.48239E-01 13640 0.141E+00 0.147E+00 DAV: 4 -0.350282072117E+03 -0.14428E-01 -0.12242E-01 15036 0.711E-01 0.126E+00 DAV: 5 -0.350276350339E+03 0.57218E-02 -0.50109E-02 14168 0.440E-01 0.629E-01 DAV: 6 -0.350276180832E+03 0.16951E-03 -0.12984E-02 13280 0.229E-01 0.365E-01 DAV: 7 -0.350276333151E+03 -0.15232E-03 -0.66561E-03 13736 0.138E-01 0.303E-01 DAV: 8 -0.350276711721E+03 -0.37857E-03 -0.56752E-03 14080 0.135E-01 0.375E-01 DAV: 9 -0.350276390544E+03 0.32118E-03 -0.61493E-03 13744 0.140E-01 0.299E-01 DAV: 10 -0.350276036861E+03 0.35368E-03 -0.24374E-03 13608 0.903E-02 0.974E-02 DAV: 11 -0.350276149263E+03 -0.11240E-03 -0.66217E-04 12888 0.562E-02 0.104E-01 DAV: 12 -0.350276109232E+03 0.40031E-04 -0.38504E-04 12352 0.403E-02 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0.313E-02 0.488E-02 DAV: 12 -0.350453530167E+03 0.67496E-05 -0.76514E-05 7536 0.205E-02 42 F= -.35045353E+03 E0= -.35043439E+03 d E =-.231543E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.350449099684E+03 0.44372E-02 -0.80397E+00 10940 0.608E+00 0.702E-01 DAV: 2 -0.350512853720E+03 -0.63754E-01 -0.44713E-01 14032 0.137E+00 0.346E+00 DAV: 3 -0.350460226401E+03 0.52627E-01 -0.26469E-01 14168 0.753E-01 0.980E-01 DAV: 4 -0.350474694440E+03 -0.14468E-01 -0.63268E-02 15728 0.545E-01 0.115E+00 DAV: 5 -0.350469000097E+03 0.56943E-02 -0.42766E-02 16480 0.435E-01 0.597E-01 DAV: 6 -0.350468485395E+03 0.51470E-03 -0.10007E-02 14280 0.221E-01 0.280E-01 DAV: 7 -0.350468760445E+03 -0.27505E-03 -0.38493E-03 13552 0.136E-01 0.259E-01 DAV: 8 -0.350468638559E+03 0.12189E-03 -0.30080E-03 14160 0.112E-01 0.226E-01 DAV: 9 -0.350468816558E+03 -0.17800E-03 -0.35004E-03 13840 0.110E-01 0.289E-01 DAV: 10 -0.350468340014E+03 0.47654E-03 -0.18091E-03 12920 0.844E-02 0.873E-02 DAV: 11 -0.350468440285E+03 -0.10027E-03 -0.42434E-04 10856 0.442E-02 0.738E-02 DAV: 12 -0.350468426370E+03 0.13914E-04 -0.15465E-04 10352 0.282E-02 0.335E-02 DAV: 13 -0.350468441021E+03 -0.14650E-04 -0.10808E-04 7416 0.197E-02 0.518E-02 DAV: 14 -0.350468426731E+03 0.14289E-04 -0.63599E-05 6504 0.168E-02 0.138E-02 DAV: 15 -0.350468433357E+03 -0.66256E-05 -0.16859E-05 6744 0.117E-02 43 F= -.35046843E+03 E0= -.35044937E+03 d E =-.380575E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.350472357671E+03 -0.39309E-02 -0.45989E+00 11044 0.460E+00 0.528E-01 DAV: 2 -0.350511732276E+03 -0.39375E-01 -0.26980E-01 14288 0.106E+00 0.267E+00 DAV: 3 -0.350477225072E+03 0.34507E-01 -0.17980E-01 13932 0.629E-01 0.634E-01 DAV: 4 -0.350487037535E+03 -0.98125E-02 -0.33179E-02 15944 0.361E-01 0.844E-01 DAV: 5 -0.350483843626E+03 0.31939E-02 -0.22467E-02 15256 0.326E-01 0.456E-01 DAV: 6 -0.350483539079E+03 0.30455E-03 -0.49229E-03 13560 0.154E-01 0.169E-01 DAV: 7 -0.350483822531E+03 -0.28345E-03 -0.12990E-03 13552 0.949E-02 0.185E-01 DAV: 8 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0.268E-01 DAV: 8 -0.350496244204E+03 0.10431E-03 -0.26404E-03 15064 0.109E-01 0.245E-01 DAV: 9 -0.350496215435E+03 0.28769E-04 -0.25230E-03 14000 0.113E-01 0.227E-01 DAV: 10 -0.350495963278E+03 0.25216E-03 -0.99093E-04 13024 0.673E-02 0.837E-02 DAV: 11 -0.350496022804E+03 -0.59525E-04 -0.34115E-04 11416 0.421E-02 0.809E-02 DAV: 12 -0.350496000483E+03 0.22321E-04 -0.18221E-04 9840 0.281E-02 0.370E-02 DAV: 13 -0.350496014791E+03 -0.14308E-04 -0.10918E-04 7336 0.205E-02 0.485E-02 DAV: 14 -0.350496002601E+03 0.12190E-04 -0.67351E-05 6544 0.172E-02 0.165E-02 DAV: 15 -0.350496008206E+03 -0.56045E-05 -0.21532E-05 6680 0.125E-02 45 F= -.35049601E+03 E0= -.35047713E+03 d E =-.275748E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.350384739380E+03 0.11126E+00 -0.39556E+01 10996 0.135E+01 0.150E+00 DAV: 2 -0.350670011627E+03 -0.28527E+00 -0.19753E+00 14064 0.315E+00 0.656E+00 DAV: 3 -0.350463254506E+03 0.20676E+00 -0.92629E-01 13972 0.179E+00 0.181E+00 DAV: 4 -0.350512160903E+03 -0.48906E-01 -0.24980E-01 15652 0.105E+00 0.240E+00 DAV: 5 -0.350488096830E+03 0.24064E-01 -0.20224E-01 15104 0.930E-01 0.136E+00 DAV: 6 -0.350484786838E+03 0.33100E-02 -0.41027E-02 14480 0.459E-01 0.563E-01 DAV: 7 -0.350486858829E+03 -0.20720E-02 -0.12654E-02 13816 0.276E-01 0.555E-01 DAV: 8 -0.350486331861E+03 0.52697E-03 -0.12512E-02 15824 0.229E-01 0.477E-01 DAV: 9 -0.350486257206E+03 0.74655E-04 -0.10475E-02 16408 0.231E-01 0.439E-01 DAV: 10 -0.350485375724E+03 0.88148E-03 -0.40279E-03 13440 0.133E-01 0.231E-01 DAV: 11 -0.350485485030E+03 -0.10931E-03 -0.14932E-03 12672 0.854E-02 0.189E-01 DAV: 12 -0.350485398002E+03 0.87028E-04 -0.86416E-04 12224 0.579E-02 0.103E-01 DAV: 13 -0.350485453017E+03 -0.55015E-04 -0.51547E-04 11328 0.437E-02 0.988E-02 DAV: 14 -0.350485420368E+03 0.32649E-04 -0.28091E-04 10240 0.345E-02 0.420E-02 DAV: 15 -0.350485435271E+03 -0.14903E-04 -0.92098E-05 8112 0.242E-02 0.415E-02 DAV: 16 -0.350485429137E+03 0.61341E-05 -0.72678E-05 6968 0.184E-02 46 F= -.35048543E+03 E0= -.35046665E+03 d E =-.169958E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.350446149837E+03 0.39285E-01 -0.21046E+01 11140 0.988E+00 0.112E+00 DAV: 2 -0.350594791183E+03 -0.14864E+00 -0.12065E+00 14080 0.227E+00 0.402E+00 DAV: 3 -0.350493784445E+03 0.10101E+00 -0.49763E-01 14520 0.153E+00 0.160E+00 DAV: 4 -0.350508723374E+03 -0.14939E-01 -0.17350E-01 15044 0.875E-01 0.181E+00 DAV: 5 -0.350497593095E+03 0.11130E-01 -0.98049E-02 15032 0.594E-01 0.812E-01 DAV: 6 -0.350497923749E+03 -0.33065E-03 -0.20420E-02 13596 0.286E-01 0.352E-01 DAV: 7 -0.350498537575E+03 -0.61383E-03 -0.64259E-03 13784 0.201E-01 0.373E-01 DAV: 8 -0.350498201915E+03 0.33566E-03 -0.63315E-03 15640 0.168E-01 0.304E-01 DAV: 9 -0.350498030262E+03 0.17165E-03 -0.36061E-03 14976 0.137E-01 0.268E-01 DAV: 10 -0.350497744070E+03 0.28619E-03 -0.20034E-03 13736 0.930E-02 0.140E-01 DAV: 11 -0.350497845508E+03 -0.10144E-03 -0.92825E-04 12520 0.635E-02 0.136E-01 DAV: 12 -0.350497763758E+03 0.81750E-04 -0.39560E-04 12128 0.423E-02 0.476E-02 DAV: 13 -0.350497796359E+03 -0.32601E-04 -0.15011E-04 8960 0.271E-02 0.598E-02 DAV: 14 -0.350497782843E+03 0.13515E-04 -0.14235E-04 7160 0.223E-02 0.295E-02 DAV: 15 -0.350497787028E+03 -0.41846E-05 -0.41509E-05 6784 0.162E-02 47 F= -.35049779E+03 E0= -.35047895E+03 d E =-.293537E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.350492915675E+03 0.48672E-02 -0.60351E+00 10900 0.532E+00 0.616E-01 DAV: 2 -0.350544910660E+03 -0.51995E-01 -0.34589E-01 14344 0.124E+00 0.303E+00 DAV: 3 -0.350500298130E+03 0.44613E-01 -0.26090E-01 14136 0.761E-01 0.771E-01 DAV: 4 -0.350511290480E+03 -0.10992E-01 -0.37535E-02 15448 0.400E-01 0.902E-01 DAV: 5 -0.350508106231E+03 0.31842E-02 -0.27154E-02 15024 0.383E-01 0.566E-01 DAV: 6 -0.350507280342E+03 0.82589E-03 -0.70839E-03 14116 0.190E-01 0.210E-01 DAV: 7 -0.350507588114E+03 -0.30777E-03 -0.16789E-03 13616 0.118E-01 0.176E-01 DAV: 8 -0.350507768418E+03 -0.18030E-03 -0.27234E-03 14256 0.918E-02 0.261E-01 DAV: 9 -0.350507433201E+03 0.33522E-03 -0.19266E-03 13144 0.941E-02 0.139E-01 DAV: 10 -0.350507443291E+03 -0.10089E-04 -0.65850E-04 12000 0.521E-02 0.705E-02 DAV: 11 -0.350507453349E+03 -0.10058E-04 -0.18041E-04 10800 0.329E-02 0.510E-02 DAV: 12 -0.350507448457E+03 0.48922E-05 -0.71525E-05 7096 0.201E-02 48 F= -.35050745E+03 E0= -.35048844E+03 d E =-.966143E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350506682688E+03 0.77066E-03 -0.59374E-01 10900 0.167E+00 0.191E-01 DAV: 2 -0.350511574997E+03 -0.48923E-02 -0.34227E-02 14304 0.385E-01 0.878E-01 DAV: 3 -0.350507284445E+03 0.42906E-02 -0.22371E-02 13884 0.249E-01 0.207E-01 DAV: 4 -0.350508392063E+03 -0.11076E-02 -0.26134E-03 13708 0.983E-02 0.223E-01 DAV: 5 -0.350508115789E+03 0.27627E-03 -0.12717E-03 13488 0.762E-02 0.959E-02 DAV: 6 -0.350508154110E+03 -0.38321E-04 -0.44879E-04 10340 0.509E-02 0.924E-02 DAV: 7 -0.350508136003E+03 0.18107E-04 -0.27813E-04 8640 0.426E-02 0.615E-02 DAV: 8 -0.350508152392E+03 -0.16389E-04 -0.26158E-04 10088 0.327E-02 0.774E-02 DAV: 9 -0.350508131528E+03 0.20864E-04 -0.21860E-04 8232 0.299E-02 0.548E-02 DAV: 10 -0.350508121943E+03 0.95853E-05 -0.73179E-05 6952 0.209E-02 49 F= -.35050812E+03 E0= -.35048898E+03 d E =-.103349E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.350506751085E+03 0.13804E-02 -0.39476E+00 10808 0.430E+00 0.487E-01 DAV: 2 -0.350536465268E+03 -0.29714E-01 -0.20880E-01 13952 0.992E-01 0.206E+00 DAV: 3 -0.350513545414E+03 0.22920E-01 -0.13897E-01 14056 0.632E-01 0.596E-01 DAV: 4 -0.350518320647E+03 -0.47752E-02 -0.18823E-02 14732 0.276E-01 0.581E-01 DAV: 5 -0.350516423790E+03 0.18969E-02 -0.81716E-03 13880 0.175E-01 0.184E-01 DAV: 6 -0.350516723606E+03 -0.29982E-03 -0.17212E-03 13856 0.999E-02 0.189E-01 DAV: 7 -0.350516732460E+03 -0.88534E-05 -0.18180E-03 14496 0.943E-02 0.208E-01 DAV: 8 -0.350516710929E+03 0.21531E-04 -0.22044E-03 13040 0.967E-02 0.200E-01 DAV: 9 -0.350516652608E+03 0.58322E-04 -0.16345E-03 12560 0.862E-02 0.168E-01 DAV: 10 -0.350516529127E+03 0.12348E-03 -0.66689E-04 12448 0.550E-02 0.449E-02 DAV: 11 -0.350516571834E+03 -0.42707E-04 -0.13657E-04 10720 0.295E-02 0.463E-02 DAV: 12 -0.350516563020E+03 0.88141E-05 -0.48188E-05 7096 0.176E-02 50 F= -.35051656E+03 E0= -.35049743E+03 d E =-.844108E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350512840358E+03 0.37315E-02 -0.24921E+00 10800 0.342E+00 0.387E-01 DAV: 2 -0.350531662232E+03 -0.18822E-01 -0.13300E-01 13976 0.786E-01 0.163E+00 DAV: 3 -0.350516979626E+03 0.14683E-01 -0.84603E-02 14068 0.514E-01 0.453E-01 DAV: 4 -0.350520268352E+03 -0.32887E-02 -0.11938E-02 14508 0.231E-01 0.477E-01 DAV: 5 -0.350519007240E+03 0.12611E-02 -0.54895E-03 13704 0.153E-01 0.192E-01 DAV: 6 -0.350519205725E+03 -0.19849E-03 -0.20889E-03 14008 0.993E-02 0.197E-01 DAV: 7 -0.350519094061E+03 0.11166E-03 -0.11655E-03 13448 0.849E-02 0.121E-01 DAV: 8 -0.350519138751E+03 -0.44690E-04 -0.77948E-04 12128 0.601E-02 0.129E-01 DAV: 9 -0.350519121556E+03 0.17196E-04 -0.79798E-04 12224 0.535E-02 0.131E-01 DAV: 10 -0.350519036360E+03 0.85196E-04 -0.36074E-04 11584 0.397E-02 0.314E-02 DAV: 11 -0.350519064103E+03 -0.27743E-04 -0.78452E-05 9088 0.229E-02 0.348E-02 DAV: 12 -0.350519059219E+03 0.48842E-05 -0.32835E-05 6584 0.145E-02 51 F= -.35051906E+03 E0= -.35049988E+03 d E =-.109373E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.350517664237E+03 0.13999E-02 -0.38817E+00 10880 0.429E+00 0.473E-01 DAV: 2 -0.350544981763E+03 -0.27318E-01 -0.19207E-01 13712 0.962E-01 0.187E+00 DAV: 3 -0.350524242108E+03 0.20740E-01 -0.10849E-01 14456 0.711E-01 0.611E-01 DAV: 4 -0.350529197329E+03 -0.49552E-02 -0.27503E-02 15292 0.367E-01 0.722E-01 DAV: 5 -0.350526703641E+03 0.24937E-02 -0.11741E-02 14744 0.246E-01 0.344E-01 DAV: 6 -0.350526816619E+03 -0.11298E-03 -0.36544E-03 13636 0.122E-01 0.174E-01 DAV: 7 -0.350526870915E+03 -0.54296E-04 -0.12228E-03 13576 0.861E-02 0.140E-01 DAV: 8 -0.350526959116E+03 -0.88201E-04 -0.15799E-03 13808 0.687E-02 0.193E-01 DAV: 9 -0.350526833171E+03 0.12594E-03 -0.13454E-03 12584 0.734E-02 0.137E-01 DAV: 10 -0.350526758249E+03 0.74922E-04 -0.43419E-04 11784 0.433E-02 0.357E-02 DAV: 11 -0.350526796004E+03 -0.37754E-04 -0.16756E-04 9944 0.284E-02 0.578E-02 DAV: 12 -0.350526777642E+03 0.18362E-04 -0.86838E-05 6712 0.195E-02 0.162E-02 DAV: 13 -0.350526784186E+03 -0.65446E-05 -0.27688E-05 6504 0.123E-02 52 F= -.35052678E+03 E0= -.35050788E+03 d E =-.772497E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350523790819E+03 0.29868E-02 -0.22960E+00 10880 0.330E+00 0.363E-01 DAV: 2 -0.350540218859E+03 -0.16428E-01 -0.11633E-01 13720 0.745E-01 0.146E+00 DAV: 3 -0.350527549026E+03 0.12670E-01 -0.66226E-02 14256 0.562E-01 0.476E-01 DAV: 4 -0.350530615938E+03 -0.30669E-02 -0.16566E-02 15252 0.288E-01 0.561E-01 DAV: 5 -0.350529075267E+03 0.15407E-02 -0.68382E-03 14532 0.184E-01 0.243E-01 DAV: 6 -0.350529222829E+03 -0.14756E-03 -0.19281E-03 13328 0.882E-02 0.134E-01 DAV: 7 -0.350529234284E+03 -0.11454E-04 -0.67276E-04 13048 0.652E-02 0.101E-01 DAV: 8 -0.350529300041E+03 -0.65757E-04 -0.92171E-04 13064 0.523E-02 0.151E-01 DAV: 9 -0.350529211566E+03 0.88474E-04 -0.82357E-04 12296 0.559E-02 0.102E-01 DAV: 10 -0.350529173928E+03 0.37638E-04 -0.24775E-04 10744 0.327E-02 0.258E-02 DAV: 11 -0.350529195792E+03 -0.21864E-04 -0.88354E-05 8168 0.216E-02 0.442E-02 DAV: 12 -0.350529184876E+03 0.10916E-04 -0.50858E-05 6448 0.155E-02 0.122E-02 DAV: 13 -0.350529188948E+03 -0.40723E-05 -0.15322E-05 6160 0.979E-03 53 F= -.35052919E+03 E0= -.35051050E+03 d E =-.101297E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.350529130663E+03 0.54212E-04 -0.25864E+00 10880 0.351E+00 0.377E-01 DAV: 2 -0.350546503908E+03 -0.17373E-01 -0.12231E-01 13528 0.785E-01 0.147E+00 DAV: 3 -0.350533615022E+03 0.12889E-01 -0.65375E-02 13816 0.575E-01 0.506E-01 DAV: 4 -0.350536938509E+03 -0.33235E-02 -0.18723E-02 15708 0.302E-01 0.599E-01 DAV: 5 -0.350535142845E+03 0.17957E-02 -0.69703E-03 14480 0.196E-01 0.241E-01 DAV: 6 -0.350535333412E+03 -0.19057E-03 -0.18417E-03 13344 0.947E-02 0.136E-01 DAV: 7 -0.350535346629E+03 -0.13217E-04 -0.53044E-04 13200 0.707E-02 0.920E-02 DAV: 8 -0.350535433969E+03 -0.87340E-04 -0.88508E-04 13056 0.568E-02 0.160E-01 DAV: 9 -0.350535303668E+03 0.13030E-03 -0.88422E-04 12552 0.540E-02 0.855E-02 DAV: 10 -0.350535301812E+03 0.18564E-05 -0.26035E-04 10544 0.307E-02 0.355E-02 DAV: 11 -0.350535311102E+03 -0.92899E-05 -0.84550E-05 7608 0.212E-02 54 F= -.35053531E+03 E0= -.35051669E+03 d E =-.612215E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350532177673E+03 0.31241E-02 -0.24248E+00 10880 0.340E+00 0.366E-01 DAV: 2 -0.350548572199E+03 -0.16395E-01 -0.11639E-01 13544 0.762E-01 0.144E+00 DAV: 3 -0.350536353918E+03 0.12218E-01 -0.62693E-02 13768 0.562E-01 0.493E-01 DAV: 4 -0.350539502830E+03 -0.31489E-02 -0.17650E-02 15780 0.295E-01 0.581E-01 DAV: 5 -0.350537790642E+03 0.17122E-02 -0.65347E-03 14240 0.187E-01 0.225E-01 DAV: 6 -0.350538001899E+03 -0.21126E-03 -0.16651E-03 13280 0.901E-02 0.136E-01 DAV: 7 -0.350538008407E+03 -0.65086E-05 -0.53327E-04 12960 0.693E-02 0.930E-02 DAV: 8 -0.350538076935E+03 -0.68527E-04 -0.77527E-04 13048 0.550E-02 0.145E-01 DAV: 9 -0.350537977280E+03 0.99654E-04 -0.79229E-04 12504 0.519E-02 0.883E-02 DAV: 10 -0.350537964873E+03 0.12407E-04 -0.27165E-04 10688 0.310E-02 0.344E-02 DAV: 11 -0.350537975067E+03 -0.10194E-04 -0.77641E-05 7544 0.207E-02 0.372E-02 DAV: 12 -0.350537969061E+03 0.60066E-05 -0.45570E-05 6248 0.150E-02 55 F= -.35053797E+03 E0= -.35051949E+03 d E =-.878011E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350537642365E+03 0.33270E-03 -0.20881E-01 10880 0.998E-01 0.111E-01 DAV: 2 -0.350539231719E+03 -0.15894E-02 -0.10390E-02 13728 0.228E-01 0.469E-01 DAV: 3 -0.350537905880E+03 0.13258E-02 -0.56310E-03 13384 0.172E-01 0.146E-01 DAV: 4 -0.350538272215E+03 -0.36633E-03 -0.14919E-03 13536 0.872E-02 0.172E-01 DAV: 5 -0.350538125917E+03 0.14630E-03 -0.56093E-04 11240 0.560E-02 0.643E-02 DAV: 6 -0.350538145563E+03 -0.19645E-04 -0.13067E-04 7732 0.268E-02 0.403E-02 DAV: 7 -0.350538146978E+03 -0.14152E-05 -0.49107E-05 7064 0.226E-02 56 F= -.35053815E+03 E0= -.35051969E+03 d E =-.895803E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350535326844E+03 0.28187E-02 -0.28697E+00 10880 0.369E+00 0.381E-01 DAV: 2 -0.350552154340E+03 -0.16827E-01 -0.11666E-01 13536 0.796E-01 0.139E+00 DAV: 3 -0.350540731326E+03 0.11423E-01 -0.45994E-02 13848 0.488E-01 0.469E-01 DAV: 4 -0.350544184764E+03 -0.34534E-02 -0.17457E-02 15724 0.291E-01 0.628E-01 DAV: 5 -0.350542135954E+03 0.20488E-02 -0.90555E-03 15088 0.214E-01 0.262E-01 DAV: 6 -0.350542308478E+03 -0.17252E-03 -0.20509E-03 13260 0.103E-01 0.137E-01 DAV: 7 -0.350542390013E+03 -0.81536E-04 -0.73639E-04 13016 0.782E-02 0.131E-01 DAV: 8 -0.350542345781E+03 0.44232E-04 -0.65809E-04 13288 0.551E-02 0.105E-01 DAV: 9 -0.350542326309E+03 0.19472E-04 -0.52631E-04 12152 0.504E-02 0.954E-02 DAV: 10 -0.350542287289E+03 0.39021E-04 -0.29995E-04 10944 0.341E-02 0.330E-02 DAV: 11 -0.350542299043E+03 -0.11754E-04 -0.63788E-05 7624 0.197E-02 0.293E-02 DAV: 12 -0.350542297063E+03 0.19798E-05 -0.41981E-05 6264 0.151E-02 57 F= -.35054230E+03 E0= -.35052380E+03 d E =-.415009E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350537049001E+03 0.52500E-02 -0.27436E+00 10880 0.361E+00 0.377E-01 DAV: 2 -0.350553587938E+03 -0.16539E-01 -0.11554E-01 13576 0.784E-01 0.138E+00 DAV: 3 -0.350542158445E+03 0.11429E-01 -0.47897E-02 13736 0.494E-01 0.462E-01 DAV: 4 -0.350545702427E+03 -0.35440E-02 -0.17942E-02 15604 0.293E-01 0.639E-01 DAV: 5 -0.350543522997E+03 0.21794E-02 -0.88763E-03 14792 0.213E-01 0.243E-01 DAV: 6 -0.350543783580E+03 -0.26058E-03 -0.19093E-03 13132 0.995E-02 0.138E-01 DAV: 7 -0.350543808499E+03 -0.24919E-04 -0.56522E-04 12920 0.736E-02 0.974E-02 DAV: 8 -0.350543848889E+03 -0.40389E-04 -0.61803E-04 13104 0.534E-02 0.129E-01 DAV: 9 -0.350543770370E+03 0.78519E-04 -0.57340E-04 12552 0.504E-02 0.834E-02 DAV: 10 -0.350543755918E+03 0.14452E-04 -0.25303E-04 10768 0.320E-02 0.360E-02 DAV: 11 -0.350543761814E+03 -0.58965E-05 -0.62007E-05 7136 0.188E-02 58 F= -.35054376E+03 E0= -.35052516E+03 d E =-.561484E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350542114626E+03 0.16413E-02 -0.20231E+00 11032 0.309E+00 0.329E-01 DAV: 2 -0.350555136497E+03 -0.13022E-01 -0.85015E-02 14368 0.684E-01 0.127E+00 DAV: 3 -0.350545517176E+03 0.96193E-02 -0.35521E-02 13680 0.395E-01 0.318E-01 DAV: 4 -0.350548279881E+03 -0.27627E-02 -0.74706E-03 14140 0.189E-01 0.457E-01 DAV: 5 -0.350547140038E+03 0.11398E-02 -0.51495E-03 14680 0.162E-01 0.196E-01 DAV: 6 -0.350547280576E+03 -0.14054E-03 -0.14017E-03 13144 0.865E-02 0.133E-01 DAV: 7 -0.350547309973E+03 -0.29397E-04 -0.73274E-04 13120 0.673E-02 0.127E-01 DAV: 8 -0.350547265662E+03 0.44311E-04 -0.56020E-04 12220 0.562E-02 0.961E-02 DAV: 9 -0.350547243572E+03 0.22091E-04 -0.37965E-04 11656 0.450E-02 0.765E-02 DAV: 10 -0.350547222237E+03 0.21334E-04 -0.20289E-04 10204 0.300E-02 0.281E-02 DAV: 11 -0.350547230340E+03 -0.81031E-05 -0.45180E-05 6720 0.177E-02 59 F= -.35054723E+03 E0= -.35052871E+03 d E =-.346853E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350546849935E+03 0.37230E-03 -0.34412E-01 11028 0.128E+00 0.135E-01 DAV: 2 -0.350549029764E+03 -0.21798E-02 -0.14416E-02 14296 0.282E-01 0.515E-01 DAV: 3 -0.350547418627E+03 0.16111E-02 -0.58698E-03 13696 0.163E-01 0.130E-01 DAV: 4 -0.350547896437E+03 -0.47781E-03 -0.12196E-03 12532 0.774E-02 0.186E-01 DAV: 5 -0.350547708728E+03 0.18771E-03 -0.84065E-04 11336 0.666E-02 0.783E-02 DAV: 6 -0.350547734492E+03 -0.25764E-04 -0.21711E-04 8592 0.357E-02 0.549E-02 DAV: 7 -0.350547739433E+03 -0.49403E-05 -0.12765E-04 7728 0.290E-02 0.532E-02 DAV: 8 -0.350547731874E+03 0.75588E-05 -0.10215E-04 7384 0.252E-02 0.390E-02 DAV: 9 -0.350547729799E+03 0.20747E-05 -0.69896E-05 6824 0.202E-02 60 F= -.35054773E+03 E0= -.35052921E+03 d E =-.396799E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350547809154E+03 -0.77280E-04 -0.10529E+00 10932 0.228E+00 0.249E-01 DAV: 2 -0.350555387679E+03 -0.75785E-02 -0.49867E-02 14624 0.511E-01 0.100E+00 DAV: 3 -0.350549284272E+03 0.61034E-02 -0.24255E-02 13912 0.304E-01 0.214E-01 DAV: 4 -0.350550780036E+03 -0.14958E-02 -0.21517E-03 12804 0.112E-01 0.248E-01 DAV: 5 -0.350550445084E+03 0.33495E-03 -0.14744E-03 13824 0.877E-02 0.123E-01 DAV: 6 -0.350550515815E+03 -0.70731E-04 -0.72944E-04 12348 0.663E-02 0.125E-01 DAV: 7 -0.350550476751E+03 0.39065E-04 -0.54688E-04 11088 0.547E-02 0.891E-02 DAV: 8 -0.350550492594E+03 -0.15843E-04 -0.42025E-04 11664 0.462E-02 0.938E-02 DAV: 9 -0.350550448201E+03 0.44393E-04 -0.26322E-04 10776 0.383E-02 0.517E-02 DAV: 10 -0.350550445045E+03 0.31556E-05 -0.94251E-05 7776 0.226E-02 61 F= -.35055045E+03 E0= -.35053210E+03 d E =-.271525E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350549413861E+03 0.10343E-02 -0.71873E-01 10932 0.188E+00 0.209E-01 DAV: 2 -0.350554802399E+03 -0.53885E-02 -0.35558E-02 14656 0.425E-01 0.853E-01 DAV: 3 -0.350550337452E+03 0.44649E-02 -0.17456E-02 13888 0.259E-01 0.176E-01 DAV: 4 -0.350551437132E+03 -0.10997E-02 -0.14560E-03 12524 0.917E-02 0.200E-01 DAV: 5 -0.350551208559E+03 0.22857E-03 -0.91032E-04 13224 0.683E-02 0.924E-02 DAV: 6 -0.350551268532E+03 -0.59973E-04 -0.47986E-04 10404 0.539E-02 0.111E-01 DAV: 7 -0.350551231268E+03 0.37264E-04 -0.42004E-04 9976 0.477E-02 0.745E-02 DAV: 8 -0.350551250021E+03 -0.18753E-04 -0.33158E-04 10560 0.402E-02 0.845E-02 DAV: 9 -0.350551212885E+03 0.37136E-04 -0.20939E-04 9128 0.328E-02 0.413E-02 DAV: 10 -0.350551212683E+03 0.20242E-06 -0.61605E-05 6904 0.194E-02 62 F= -.35055121E+03 E0= -.35053301E+03 d E =-.348288E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350551614309E+03 -0.40142E-03 -0.60879E-01 10948 0.173E+00 0.183E-01 DAV: 2 -0.350555709860E+03 -0.40956E-02 -0.27435E-02 14512 0.380E-01 0.728E-01 DAV: 3 -0.350552471573E+03 0.32383E-02 -0.12678E-02 13852 0.221E-01 0.161E-01 DAV: 4 -0.350553286606E+03 -0.81503E-03 -0.11678E-03 12700 0.814E-02 0.181E-01 DAV: 5 -0.350553084216E+03 0.20239E-03 -0.68138E-04 12976 0.571E-02 0.641E-02 DAV: 6 -0.350553137135E+03 -0.52919E-04 -0.26752E-04 9796 0.366E-02 0.818E-02 DAV: 7 -0.350553130350E+03 0.67856E-05 -0.35760E-04 9568 0.423E-02 0.817E-02 DAV: 8 -0.350553145226E+03 -0.14876E-04 -0.39221E-04 9360 0.450E-02 0.984E-02 DAV: 9 -0.350553092058E+03 0.53168E-04 -0.21429E-04 8032 0.334E-02 0.259E-02 DAV: 10 -0.350553104274E+03 -0.12216E-04 -0.45634E-05 6664 0.168E-02 0.192E-02 DAV: 11 -0.350553104705E+03 -0.43085E-06 -0.17856E-05 6488 0.117E-02 63 F= -.35055310E+03 E0= -.35053497E+03 d E =-.189202E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350547779270E+03 0.53250E-02 -0.28904E+00 10948 0.378E+00 0.402E-01 DAV: 2 -0.350567567876E+03 -0.19789E-01 -0.13259E-01 14528 0.828E-01 0.162E+00 DAV: 3 -0.350551967060E+03 0.15601E-01 -0.67364E-02 13892 0.477E-01 0.348E-01 DAV: 4 -0.350555756713E+03 -0.37897E-02 -0.59480E-03 12972 0.177E-01 0.410E-01 DAV: 5 -0.350554730114E+03 0.10266E-02 -0.34972E-03 13624 0.124E-01 0.138E-01 DAV: 6 -0.350554946673E+03 -0.21656E-03 -0.91326E-04 12700 0.729E-02 0.143E-01 DAV: 7 -0.350554946531E+03 0.14178E-06 -0.12046E-03 13328 0.670E-02 0.150E-01 DAV: 8 -0.350554874827E+03 0.71704E-04 -0.94378E-04 12196 0.666E-02 0.115E-01 DAV: 9 -0.350554821465E+03 0.53362E-04 -0.43881E-04 11784 0.381E-02 0.444E-02 DAV: 10 -0.350554844244E+03 -0.22779E-04 -0.15750E-04 8832 0.281E-02 0.541E-02 DAV: 11 -0.350554836792E+03 0.74521E-05 -0.11038E-04 6616 0.269E-02 0.406E-02 DAV: 12 -0.350554832137E+03 0.46550E-05 -0.46207E-05 6264 0.180E-02 64 F= -.35055483E+03 E0= -.35053687E+03 d E =-.361945E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350554062099E+03 0.77469E-03 -0.12057E+00 10984 0.244E+00 0.260E-01 DAV: 2 -0.350562540359E+03 -0.84783E-02 -0.54524E-02 14704 0.532E-01 0.108E+00 DAV: 3 -0.350555623875E+03 0.69165E-02 -0.25737E-02 13624 0.310E-01 0.230E-01 DAV: 4 -0.350557593751E+03 -0.19699E-02 -0.37998E-03 13408 0.138E-01 0.338E-01 DAV: 5 -0.350556959363E+03 0.63439E-03 -0.29165E-03 14152 0.116E-01 0.137E-01 DAV: 6 -0.350557065391E+03 -0.10603E-03 -0.73874E-04 12656 0.652E-02 0.107E-01 DAV: 7 -0.350557061704E+03 0.36870E-05 -0.39292E-04 11264 0.523E-02 0.897E-02 DAV: 8 -0.350557056079E+03 0.56245E-05 -0.37741E-04 12112 0.398E-02 0.802E-02 DAV: 9 -0.350557035164E+03 0.20915E-04 -0.27100E-04 10336 0.361E-02 0.612E-02 DAV: 10 -0.350557020827E+03 0.14337E-04 -0.11570E-04 8288 0.232E-02 0.214E-02 DAV: 11 -0.350557028087E+03 -0.72605E-05 -0.43074E-05 6704 0.150E-02 65 F= -.35055703E+03 E0= -.35053901E+03 d E =-.219595E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350555680992E+03 0.13398E-02 -0.10093E+00 10992 0.223E+00 0.237E-01 DAV: 2 -0.350562601730E+03 -0.69207E-02 -0.46192E-02 14704 0.485E-01 0.968E-01 DAV: 3 -0.350557044760E+03 0.55570E-02 -0.21923E-02 13560 0.274E-01 0.213E-01 DAV: 4 -0.350558564655E+03 -0.15199E-02 -0.26538E-03 13168 0.116E-01 0.277E-01 DAV: 5 -0.350558128961E+03 0.43569E-03 -0.19205E-03 13752 0.934E-02 0.119E-01 DAV: 6 -0.350558204347E+03 -0.75386E-04 -0.61752E-04 11720 0.601E-02 0.103E-01 DAV: 7 -0.350558197951E+03 0.63962E-05 -0.38913E-04 10664 0.507E-02 0.902E-02 DAV: 8 -0.350558186607E+03 0.11344E-04 -0.35609E-04 11224 0.378E-02 0.723E-02 DAV: 9 -0.350558172966E+03 0.13641E-04 -0.22324E-04 9736 0.338E-02 0.568E-02 DAV: 10 -0.350558159663E+03 0.13303E-04 -0.96044E-05 7432 0.218E-02 0.206E-02 DAV: 11 -0.350558165483E+03 -0.58199E-05 -0.37240E-05 6600 0.149E-02 66 F= -.35055817E+03 E0= -.35054012E+03 d E =-.333335E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350547981457E+03 0.10178E-01 -0.40360E+00 11008 0.446E+00 0.472E-01 DAV: 2 -0.350575444875E+03 -0.27463E-01 -0.18262E-01 14712 0.971E-01 0.195E+00 DAV: 3 -0.350553786905E+03 0.21658E-01 -0.92266E-02 13656 0.541E-01 0.430E-01 DAV: 4 -0.350559598192E+03 -0.58113E-02 -0.11837E-02 13456 0.235E-01 0.577E-01 DAV: 5 -0.350557715365E+03 0.18828E-02 -0.87907E-03 14648 0.190E-01 0.237E-01 DAV: 6 -0.350558068562E+03 -0.35320E-03 -0.25303E-03 14328 0.120E-01 0.214E-01 DAV: 7 -0.350558023535E+03 0.45027E-04 -0.16392E-03 14072 0.101E-01 0.177E-01 DAV: 8 -0.350557980801E+03 0.42734E-04 -0.12804E-03 13976 0.742E-02 0.141E-01 DAV: 9 -0.350557940415E+03 0.40385E-04 -0.96588E-04 12808 0.659E-02 0.124E-01 DAV: 10 -0.350557873551E+03 0.66864E-04 -0.44210E-04 11912 0.412E-02 0.420E-02 DAV: 11 -0.350557899169E+03 -0.25618E-04 -0.14544E-04 9136 0.247E-02 0.535E-02 DAV: 12 -0.350557885314E+03 0.13855E-04 -0.75211E-05 6600 0.176E-02 0.179E-02 DAV: 13 -0.350557890982E+03 -0.56683E-05 -0.32892E-05 6632 0.123E-02 67 F= -.35055789E+03 E0= -.35053981E+03 d E =-.305885E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350554537776E+03 0.33475E-02 -0.16010E+00 11008 0.281E+00 0.300E-01 DAV: 2 -0.350565086495E+03 -0.10549E-01 -0.71769E-02 14656 0.607E-01 0.114E+00 DAV: 3 -0.350557070089E+03 0.80164E-02 -0.27459E-02 13688 0.337E-01 0.271E-01 DAV: 4 -0.350559003181E+03 -0.19331E-02 -0.33478E-03 13292 0.139E-01 0.314E-01 DAV: 5 -0.350558426943E+03 0.57624E-03 -0.21124E-03 13696 0.105E-01 0.141E-01 DAV: 6 -0.350558533751E+03 -0.10681E-03 -0.99365E-04 13072 0.761E-02 0.133E-01 DAV: 7 -0.350558527251E+03 0.64997E-05 -0.71980E-04 12160 0.657E-02 0.127E-01 DAV: 8 -0.350558487606E+03 0.39645E-04 -0.67643E-04 12096 0.498E-02 0.893E-02 DAV: 9 -0.350558471913E+03 0.15693E-04 -0.35082E-04 11040 0.425E-02 0.653E-02 DAV: 10 -0.350558454195E+03 0.17718E-04 -0.12792E-04 9928 0.254E-02 0.206E-02 DAV: 11 -0.350558462119E+03 -0.79244E-05 -0.44986E-05 6848 0.175E-02 68 F= -.35055846E+03 E0= -.35054038E+03 d E =-.362998E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350556271321E+03 0.21829E-02 -0.17430E+00 10996 0.292E+00 0.325E-01 DAV: 2 -0.350569287864E+03 -0.13017E-01 -0.85156E-02 14728 0.653E-01 0.137E+00 DAV: 3 -0.350558397954E+03 0.10890E-01 -0.45221E-02 14204 0.414E-01 0.316E-01 DAV: 4 -0.350561706090E+03 -0.33081E-02 -0.87287E-03 14588 0.208E-01 0.508E-01 DAV: 5 -0.350560341297E+03 0.13648E-02 -0.65854E-03 14704 0.181E-01 0.199E-01 DAV: 6 -0.350560507558E+03 -0.16626E-03 -0.11562E-03 13456 0.831E-02 0.111E-01 DAV: 7 -0.350560557587E+03 -0.50029E-04 -0.62952E-04 12856 0.619E-02 0.128E-01 DAV: 8 -0.350560514105E+03 0.43482E-04 -0.66592E-04 13032 0.514E-02 0.924E-02 DAV: 9 -0.350560502427E+03 0.11679E-04 -0.40703E-04 11752 0.438E-02 0.824E-02 DAV: 10 -0.350560469702E+03 0.32725E-04 -0.20995E-04 10064 0.288E-02 0.245E-02 DAV: 11 -0.350560481926E+03 -0.12224E-04 -0.57124E-05 6856 0.170E-02 0.330E-02 DAV: 12 -0.350560476721E+03 0.52051E-05 -0.34978E-05 6136 0.134E-02 69 F= -.35056048E+03 E0= -.35054238E+03 d E =-.201460E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350560436966E+03 0.44960E-04 -0.36825E-02 11012 0.425E-01 0.489E-02 DAV: 2 -0.350560757066E+03 -0.32010E-03 -0.19169E-03 14736 0.970E-02 0.220E-01 DAV: 3 -0.350560456506E+03 0.30056E-03 -0.94808E-04 13264 0.629E-02 0.450E-02 DAV: 4 -0.350560549412E+03 -0.92906E-04 -0.16249E-04 7784 0.304E-02 0.687E-02 DAV: 5 -0.350560525781E+03 0.23631E-04 -0.12868E-04 6464 0.275E-02 0.314E-02 DAV: 6 -0.350560527358E+03 -0.15773E-05 -0.27190E-05 6136 0.138E-02 70 F= -.35056053E+03 E0= -.35054245E+03 d E =-.206524E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350559697587E+03 0.82819E-03 -0.12197E+00 10928 0.244E+00 0.280E-01 DAV: 2 -0.350570162135E+03 -0.10465E-01 -0.69658E-02 14376 0.563E-01 0.126E+00 DAV: 3 -0.350560791496E+03 0.93706E-02 -0.38457E-02 13756 0.382E-01 0.243E-01 DAV: 4 -0.350563460122E+03 -0.26686E-02 -0.57749E-03 14004 0.174E-01 0.417E-01 DAV: 5 -0.350562510980E+03 0.94914E-03 -0.41883E-03 14560 0.149E-01 0.148E-01 DAV: 6 -0.350562676778E+03 -0.16580E-03 -0.84103E-04 13136 0.683E-02 0.109E-01 DAV: 7 -0.350562667820E+03 0.89576E-05 -0.39877E-04 11528 0.491E-02 0.883E-02 DAV: 8 -0.350562678817E+03 -0.10997E-04 -0.40479E-04 11648 0.420E-02 0.929E-02 DAV: 9 -0.350562653800E+03 0.25017E-04 -0.34200E-04 10352 0.403E-02 0.728E-02 DAV: 10 -0.350562631055E+03 0.22746E-04 -0.14139E-04 8416 0.263E-02 0.210E-02 DAV: 11 -0.350562639768E+03 -0.87135E-05 -0.33128E-05 6464 0.172E-02 71 F= -.35056264E+03 E0= -.35054451E+03 d E =-.211241E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350561226683E+03 0.14044E-02 -0.10209E+00 10940 0.223E+00 0.258E-01 DAV: 2 -0.350569981126E+03 -0.87544E-02 -0.58200E-02 14376 0.517E-01 0.115E+00 DAV: 3 -0.350562169168E+03 0.78120E-02 -0.31762E-02 13680 0.351E-01 0.225E-01 DAV: 4 -0.350564334712E+03 -0.21655E-02 -0.44139E-03 13768 0.154E-01 0.361E-01 DAV: 5 -0.350563647671E+03 0.68704E-03 -0.33484E-03 14464 0.134E-01 0.148E-01 DAV: 6 -0.350563731888E+03 -0.84218E-04 -0.73653E-04 13128 0.639E-02 0.925E-02 DAV: 7 -0.350563740952E+03 -0.90639E-05 -0.33911E-04 10880 0.441E-02 0.853E-02 DAV: 8 -0.350563734155E+03 0.67970E-05 -0.31587E-04 11080 0.368E-02 0.731E-02 DAV: 9 -0.350563728180E+03 0.59751E-05 -0.24356E-04 9624 0.357E-02 0.680E-02 DAV: 10 -0.350563704982E+03 0.23198E-04 -0.12378E-04 7544 0.245E-02 0.192E-02 DAV: 11 -0.350563712527E+03 -0.75447E-05 -0.26779E-05 6400 0.165E-02 72 F= -.35056371E+03 E0= -.35054557E+03 d E =-.318517E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350553557751E+03 0.10147E-01 -0.40828E+00 10948 0.446E+00 0.516E-01 DAV: 2 -0.350588726403E+03 -0.35169E-01 -0.23489E-01 14384 0.103E+00 0.231E+00 DAV: 3 -0.350557877084E+03 0.30849E-01 -0.12177E-01 13796 0.693E-01 0.445E-01 DAV: 4 -0.350565384289E+03 -0.75072E-02 -0.14219E-02 13604 0.279E-01 0.614E-01 DAV: 5 -0.350563531643E+03 0.18526E-02 -0.11362E-02 14760 0.244E-01 0.334E-01 DAV: 6 -0.350563538834E+03 -0.71913E-05 -0.36239E-03 14488 0.136E-01 0.192E-01 DAV: 7 -0.350563609735E+03 -0.70901E-04 -0.15492E-03 13384 0.924E-02 0.181E-01 DAV: 8 -0.350563545461E+03 0.64274E-04 -0.12746E-03 13760 0.728E-02 0.137E-01 DAV: 9 -0.350563560521E+03 -0.15060E-04 -0.97273E-04 12088 0.706E-02 0.145E-01 DAV: 10 -0.350563445899E+03 0.11462E-03 -0.53732E-04 12360 0.484E-02 0.400E-02 DAV: 11 -0.350563480472E+03 -0.34573E-04 -0.12739E-04 9472 0.307E-02 0.478E-02 DAV: 12 -0.350563470388E+03 0.10084E-04 -0.78092E-05 6792 0.186E-02 0.218E-02 DAV: 13 -0.350563473964E+03 -0.35754E-05 -0.28669E-05 6448 0.155E-02 73 F= -.35056347E+03 E0= -.35054528E+03 d E =-.294661E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350560162824E+03 0.33076E-02 -0.15887E+00 10952 0.278E+00 0.325E-01 DAV: 2 -0.350573655385E+03 -0.13493E-01 -0.90141E-02 14408 0.646E-01 0.138E+00 DAV: 3 -0.350561943666E+03 0.11712E-01 -0.52157E-02 13988 0.441E-01 0.300E-01 DAV: 4 -0.350565511846E+03 -0.35682E-02 -0.10938E-02 15004 0.226E-01 0.574E-01 DAV: 5 -0.350563678777E+03 0.18331E-02 -0.70469E-03 14920 0.191E-01 0.148E-01 DAV: 6 -0.350564046270E+03 -0.36749E-03 -0.88201E-04 12536 0.743E-02 0.112E-01 DAV: 7 -0.350564041884E+03 0.43859E-05 -0.49083E-04 12792 0.515E-02 0.954E-02 DAV: 8 -0.350564064133E+03 -0.22249E-04 -0.64161E-04 12264 0.482E-02 0.112E-01 DAV: 9 -0.350564021549E+03 0.42584E-04 -0.52329E-04 11664 0.435E-02 0.805E-02 DAV: 10 -0.350563995169E+03 0.26381E-04 -0.17750E-04 9664 0.280E-02 0.256E-02 DAV: 11 -0.350564006765E+03 -0.11596E-04 -0.51200E-05 7200 0.191E-02 0.331E-02 DAV: 12 -0.350564001343E+03 0.54220E-05 -0.32384E-05 6472 0.137E-02 74 F= -.35056400E+03 E0= -.35054584E+03 d E =-.347398E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350560947186E+03 0.30596E-02 -0.20673E+00 10896 0.316E+00 0.358E-01 DAV: 2 -0.350577006815E+03 -0.16060E-01 -0.10560E-01 14232 0.713E-01 0.150E+00 DAV: 3 -0.350563406847E+03 0.13600E-01 -0.50272E-02 13816 0.449E-01 0.318E-01 DAV: 4 -0.350566681857E+03 -0.32750E-02 -0.61381E-03 13292 0.169E-01 0.376E-01 DAV: 5 -0.350565905620E+03 0.77624E-03 -0.41488E-03 13872 0.126E-01 0.185E-01 DAV: 6 -0.350566023369E+03 -0.11775E-03 -0.14921E-03 13544 0.932E-02 0.161E-01 DAV: 7 -0.350565995112E+03 0.28257E-04 -0.11544E-03 12432 0.798E-02 0.140E-01 DAV: 8 -0.350565981412E+03 0.13700E-04 -0.87579E-04 12232 0.567E-02 0.119E-01 DAV: 9 -0.350565959434E+03 0.21978E-04 -0.57908E-04 11920 0.536E-02 0.103E-01 DAV: 10 -0.350565907784E+03 0.51649E-04 -0.26583E-04 10656 0.357E-02 0.290E-02 DAV: 11 -0.350565928548E+03 -0.20764E-04 -0.99633E-05 7832 0.219E-02 0.441E-02 DAV: 12 -0.350565918550E+03 0.99977E-05 -0.53238E-05 6256 0.161E-02 75 F= -.35056592E+03 E0= -.35054763E+03 d E =-.191721E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350565729558E+03 0.19899E-03 -0.12675E-01 10920 0.784E-01 0.904E-02 DAV: 2 -0.350566793272E+03 -0.10637E-02 -0.67115E-03 14288 0.179E-01 0.396E-01 DAV: 3 -0.350565824256E+03 0.96902E-03 -0.33509E-03 13672 0.115E-01 0.772E-02 DAV: 4 -0.350566080244E+03 -0.25599E-03 -0.34525E-04 10864 0.416E-02 0.883E-02 DAV: 5 -0.350566033626E+03 0.46618E-04 -0.19744E-04 8016 0.304E-02 0.351E-02 DAV: 6 -0.350566042344E+03 -0.87181E-05 -0.59788E-05 7172 0.198E-02 76 F= -.35056604E+03 E0= -.35054773E+03 d E =-.204100E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350564534153E+03 0.14995E-02 -0.14261E+00 10896 0.262E+00 0.319E-01 DAV: 2 -0.350579525061E+03 -0.14991E-01 -0.89241E-02 14640 0.645E-01 0.154E+00 DAV: 3 -0.350565030585E+03 0.14494E-01 -0.53193E-02 13940 0.487E-01 0.302E-01 DAV: 4 -0.350568980642E+03 -0.39501E-02 -0.10322E-02 14260 0.225E-01 0.485E-01 DAV: 5 -0.350567776731E+03 0.12039E-02 -0.58069E-03 13792 0.167E-01 0.176E-01 DAV: 6 -0.350567941542E+03 -0.16481E-03 -0.11887E-03 13000 0.687E-02 0.115E-01 DAV: 7 -0.350567964580E+03 -0.23038E-04 -0.48258E-04 12808 0.541E-02 0.100E-01 DAV: 8 -0.350567975703E+03 -0.11123E-04 -0.54726E-04 12032 0.432E-02 0.109E-01 DAV: 9 -0.350567935152E+03 0.40551E-04 -0.41849E-04 11584 0.455E-02 0.754E-02 DAV: 10 -0.350567914257E+03 0.20895E-04 -0.17214E-04 9440 0.265E-02 0.272E-02 DAV: 11 -0.350567927726E+03 -0.13469E-04 -0.72056E-05 6800 0.186E-02 0.393E-02 DAV: 12 -0.350567919116E+03 0.86101E-05 -0.37760E-05 6240 0.147E-02 77 F= -.35056792E+03 E0= -.35054956E+03 d E =-.187677E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350565573496E+03 0.23542E-02 -0.12464E+00 10912 0.245E+00 0.297E-01 DAV: 2 -0.350577732998E+03 -0.12160E-01 -0.74545E-02 14488 0.580E-01 0.137E+00 DAV: 3 -0.350566179056E+03 0.11554E-01 -0.41951E-02 14004 0.401E-01 0.227E-01 DAV: 4 -0.350569088044E+03 -0.29090E-02 -0.39909E-03 12956 0.144E-01 0.314E-01 DAV: 5 -0.350568550274E+03 0.53777E-03 -0.27163E-03 13336 0.115E-01 0.140E-01 DAV: 6 -0.350568646357E+03 -0.96083E-04 -0.94261E-04 12648 0.715E-02 0.132E-01 DAV: 7 -0.350568610510E+03 0.35847E-04 -0.57456E-04 11632 0.556E-02 0.913E-02 DAV: 8 -0.350568626297E+03 -0.15787E-04 -0.44193E-04 10976 0.451E-02 0.939E-02 DAV: 9 -0.350568603322E+03 0.22974E-04 -0.35996E-04 10768 0.413E-02 0.752E-02 DAV: 10 -0.350568577760E+03 0.25563E-04 -0.15537E-04 8048 0.268E-02 0.229E-02 DAV: 11 -0.350568591335E+03 -0.13576E-04 -0.61447E-05 6536 0.179E-02 0.361E-02 DAV: 12 -0.350568584353E+03 0.69829E-05 -0.33256E-05 6408 0.137E-02 78 F= -.35056858E+03 E0= -.35055019E+03 d E =-.254201E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350566909901E+03 0.16814E-02 -0.15511E+00 10856 0.273E+00 0.378E-01 DAV: 2 -0.350591159862E+03 -0.24250E-01 -0.12855E-01 14976 0.766E-01 0.206E+00 DAV: 3 -0.350565489543E+03 0.25670E-01 -0.96215E-02 14232 0.667E-01 0.443E-01 DAV: 4 -0.350571090307E+03 -0.56008E-02 -0.14443E-02 12984 0.260E-01 0.427E-01 DAV: 5 -0.350570454365E+03 0.63594E-03 -0.50113E-03 12840 0.160E-01 0.190E-01 DAV: 6 -0.350570468426E+03 -0.14061E-04 -0.14383E-03 13376 0.716E-02 0.119E-01 DAV: 7 -0.350570480967E+03 -0.12541E-04 -0.41474E-04 12512 0.537E-02 0.875E-02 DAV: 8 -0.350570512573E+03 -0.31606E-04 -0.50735E-04 12024 0.457E-02 0.112E-01 DAV: 9 -0.350570461610E+03 0.50963E-04 -0.46155E-04 11720 0.441E-02 0.745E-02 DAV: 10 -0.350570442963E+03 0.18647E-04 -0.17686E-04 9592 0.262E-02 0.275E-02 DAV: 11 -0.350570456559E+03 -0.13597E-04 -0.68783E-05 6936 0.185E-02 0.397E-02 DAV: 12 -0.350570447525E+03 0.90339E-05 -0.33657E-05 6120 0.146E-02 79 F= -.35057045E+03 E0= -.35055222E+03 d E =-.186317E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350568946668E+03 0.15099E-02 -0.96705E-01 10856 0.215E+00 0.298E-01 DAV: 2 -0.350584199216E+03 -0.15253E-01 -0.79262E-02 15000 0.605E-01 0.164E+00 DAV: 3 -0.350567864920E+03 0.16334E-01 -0.59983E-02 14200 0.531E-01 0.354E-01 DAV: 4 -0.350571549705E+03 -0.36848E-02 -0.90182E-03 12972 0.206E-01 0.336E-01 DAV: 5 -0.350571161032E+03 0.38867E-03 -0.31127E-03 12912 0.127E-01 0.148E-01 DAV: 6 -0.350571170394E+03 -0.93621E-05 -0.86803E-04 13112 0.561E-02 0.940E-02 DAV: 7 -0.350571176695E+03 -0.63018E-05 -0.25435E-04 11448 0.423E-02 0.683E-02 DAV: 8 -0.350571197821E+03 -0.21125E-04 -0.31670E-04 11584 0.366E-02 0.882E-02 DAV: 9 -0.350571165216E+03 0.32605E-04 -0.27979E-04 9672 0.356E-02 0.578E-02 DAV: 10 -0.350571154094E+03 0.11122E-04 -0.10610E-04 7680 0.212E-02 0.211E-02 DAV: 11 -0.350571162841E+03 -0.87471E-05 -0.44759E-05 6272 0.151E-02 80 F= -.35057116E+03 E0= -.35055306E+03 d E =-.257849E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350561907841E+03 0.92463E-02 -0.38669E+00 10856 0.431E+00 0.596E-01 DAV: 2 -0.350622020686E+03 -0.60113E-01 -0.32883E-01 15064 0.121E+00 0.320E+00 DAV: 3 -0.350559638701E+03 0.62382E-01 -0.24338E-01 14492 0.106E+00 0.705E-01 DAV: 4 -0.350572232842E+03 -0.12594E-01 -0.37241E-02 13048 0.410E-01 0.654E-01 DAV: 5 -0.350570832339E+03 0.14005E-02 -0.12521E-02 12784 0.251E-01 0.314E-01 DAV: 6 -0.350570774526E+03 0.57813E-04 -0.39415E-03 13408 0.115E-01 0.186E-01 DAV: 7 -0.350570837366E+03 -0.62840E-04 -0.11342E-03 13832 0.842E-02 0.148E-01 DAV: 8 -0.350570866584E+03 -0.29218E-04 -0.12002E-03 12752 0.707E-02 0.162E-01 DAV: 9 -0.350570793146E+03 0.73437E-04 -0.11448E-03 12872 0.670E-02 0.129E-01 DAV: 10 -0.350570719903E+03 0.73243E-04 -0.52656E-04 12080 0.418E-02 0.436E-02 DAV: 11 -0.350570756859E+03 -0.36956E-04 -0.17307E-04 9928 0.284E-02 0.631E-02 DAV: 12 -0.350570733623E+03 0.23237E-04 -0.78119E-05 6520 0.214E-02 0.164E-02 DAV: 13 -0.350570742837E+03 -0.92148E-05 -0.31365E-05 6680 0.133E-02 81 F= -.35057074E+03 E0= -.35055288E+03 d E =-.215848E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350566940977E+03 0.37926E-02 -0.19240E+00 10880 0.304E+00 0.422E-01 DAV: 2 -0.350597065787E+03 -0.30125E-01 -0.14209E-01 14904 0.840E-01 0.231E+00 DAV: 3 -0.350565181713E+03 0.31884E-01 -0.91486E-02 14320 0.748E-01 0.510E-01 DAV: 4 -0.350572134119E+03 -0.69524E-02 -0.17789E-02 13308 0.293E-01 0.488E-01 DAV: 5 -0.350571361422E+03 0.77270E-03 -0.69587E-03 13032 0.185E-01 0.234E-01 DAV: 6 -0.350571314520E+03 0.46902E-04 -0.18382E-03 13208 0.873E-02 0.125E-01 DAV: 7 -0.350571338039E+03 -0.23519E-04 -0.46426E-04 13128 0.615E-02 0.904E-02 DAV: 8 -0.350571405123E+03 -0.67084E-04 -0.74179E-04 12456 0.570E-02 0.141E-01 DAV: 9 -0.350571291265E+03 0.11386E-03 -0.47796E-04 11920 0.500E-02 0.572E-02 DAV: 10 -0.350571301810E+03 -0.10545E-04 -0.15396E-04 10240 0.257E-02 0.354E-02 DAV: 11 -0.350571307812E+03 -0.60023E-05 -0.74144E-05 6944 0.195E-02 82 F= -.35057131E+03 E0= -.35055324E+03 d E =-.272346E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350568745571E+03 0.25562E-02 -0.18569E+00 10852 0.298E+00 0.447E-01 DAV: 2 -0.350605122275E+03 -0.36377E-01 -0.17148E-01 15496 0.904E-01 0.258E+00 DAV: 3 -0.350565188322E+03 0.39934E-01 -0.15569E-01 14904 0.836E-01 0.575E-01 DAV: 4 -0.350573261107E+03 -0.80728E-02 -0.19613E-02 12864 0.300E-01 0.419E-01 DAV: 5 -0.350572895755E+03 0.36535E-03 -0.49234E-03 12544 0.169E-01 0.195E-01 DAV: 6 -0.350572878467E+03 0.17288E-04 -0.16001E-03 13536 0.761E-02 0.140E-01 DAV: 7 -0.350572861582E+03 0.16885E-04 -0.50472E-04 13064 0.580E-02 0.957E-02 DAV: 8 -0.350572896187E+03 -0.34605E-04 -0.48594E-04 12000 0.488E-02 0.115E-01 DAV: 9 -0.350572836215E+03 0.59973E-04 -0.42151E-04 12152 0.454E-02 0.745E-02 DAV: 10 -0.350572819802E+03 0.16413E-04 -0.18044E-04 10072 0.281E-02 0.287E-02 DAV: 11 -0.350572830848E+03 -0.11046E-04 -0.61776E-05 6760 0.176E-02 0.337E-02 DAV: 12 -0.350572825100E+03 0.57479E-05 -0.31400E-05 6000 0.134E-02 83 F= -.35057283E+03 E0= -.35055476E+03 d E =-.151729E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350572431854E+03 0.39899E-03 -0.25028E-01 10876 0.109E+00 0.163E-01 DAV: 2 -0.350577421198E+03 -0.49893E-02 -0.22975E-02 15424 0.331E-01 0.974E-01 DAV: 3 -0.350571758191E+03 0.56630E-02 -0.19128E-02 14484 0.310E-01 0.213E-01 DAV: 4 -0.350573043784E+03 -0.12856E-02 -0.25484E-03 12620 0.109E-01 0.153E-01 DAV: 5 -0.350573001711E+03 0.42073E-04 -0.69500E-04 12816 0.625E-02 0.790E-02 DAV: 6 -0.350572991354E+03 0.10357E-04 -0.20399E-04 8760 0.294E-02 0.500E-02 DAV: 7 -0.350572992518E+03 -0.11643E-05 -0.60483E-05 7368 0.225E-02 84 F= -.35057299E+03 E0= -.35055501E+03 d E =-.168471E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350570805274E+03 0.21861E-02 -0.18387E+00 10884 0.296E+00 0.457E-01 DAV: 2 -0.350609218222E+03 -0.38413E-01 -0.16679E-01 15480 0.896E-01 0.268E+00 DAV: 3 -0.350566433030E+03 0.42785E-01 -0.17093E-01 14900 0.828E-01 0.567E-01 DAV: 4 -0.350575125196E+03 -0.86922E-02 -0.18917E-02 12436 0.294E-01 0.402E-01 DAV: 5 -0.350574863938E+03 0.26126E-03 -0.48064E-03 12536 0.168E-01 0.207E-01 DAV: 6 -0.350574794488E+03 0.69450E-04 -0.16738E-03 13400 0.768E-02 0.134E-01 DAV: 7 -0.350574839988E+03 -0.45500E-04 -0.68686E-04 13664 0.611E-02 0.132E-01 DAV: 8 -0.350574799517E+03 0.40471E-04 -0.59469E-04 12312 0.515E-02 0.101E-01 DAV: 9 -0.350574784578E+03 0.14939E-04 -0.44033E-04 11808 0.467E-02 0.875E-02 DAV: 10 -0.350574752218E+03 0.32360E-04 -0.23214E-04 10392 0.308E-02 0.352E-02 DAV: 11 -0.350574765328E+03 -0.13110E-04 -0.92533E-05 7576 0.204E-02 0.398E-02 DAV: 12 -0.350574757399E+03 0.79291E-05 -0.32751E-05 6440 0.145E-02 85 F= -.35057476E+03 E0= -.35055651E+03 d E =-.176488E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350573393441E+03 0.13719E-02 -0.80963E-01 10868 0.196E+00 0.303E-01 DAV: 2 -0.350590268531E+03 -0.16875E-01 -0.74068E-02 15448 0.594E-01 0.180E+00 DAV: 3 -0.350571175575E+03 0.19093E-01 -0.72224E-02 14660 0.553E-01 0.373E-01 DAV: 4 -0.350575385751E+03 -0.42102E-02 -0.85266E-03 12536 0.197E-01 0.283E-01 DAV: 5 -0.350575199675E+03 0.18608E-03 -0.22930E-03 13048 0.114E-01 0.133E-01 DAV: 6 -0.350575189560E+03 0.10115E-04 -0.70087E-04 12928 0.513E-02 0.912E-02 DAV: 7 -0.350575188197E+03 0.13633E-05 -0.19295E-04 10112 0.392E-02 0.632E-02 DAV: 8 -0.350575206363E+03 -0.18166E-04 -0.22617E-04 10840 0.340E-02 0.795E-02 DAV: 9 -0.350575172214E+03 0.34149E-04 -0.16965E-04 8928 0.308E-02 0.406E-02 DAV: 10 -0.350575173208E+03 -0.99425E-06 -0.68031E-05 7392 0.192E-02 86 F= -.35057517E+03 E0= -.35055683E+03 d E =-.218069E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350572607119E+03 0.25651E-02 -0.20720E+00 10952 0.315E+00 0.468E-01 DAV: 2 -0.350611354625E+03 -0.38748E-01 -0.17231E-01 15440 0.921E-01 0.267E+00 DAV: 3 -0.350568920183E+03 0.42434E-01 -0.17127E-01 14648 0.831E-01 0.574E-01 DAV: 4 -0.350577736601E+03 -0.88164E-02 -0.21580E-02 12652 0.309E-01 0.460E-01 DAV: 5 -0.350577156931E+03 0.57967E-03 -0.62967E-03 12800 0.186E-01 0.210E-01 DAV: 6 -0.350577142417E+03 0.14514E-04 -0.19171E-03 13248 0.821E-02 0.139E-01 DAV: 7 -0.350577158854E+03 -0.16437E-04 -0.77294E-04 13064 0.623E-02 0.123E-01 DAV: 8 -0.350577155224E+03 0.36299E-05 -0.65880E-04 12632 0.523E-02 0.118E-01 DAV: 9 -0.350577110240E+03 0.44984E-04 -0.39071E-04 11616 0.474E-02 0.812E-02 DAV: 10 -0.350577088883E+03 0.21357E-04 -0.20230E-04 10456 0.315E-02 0.349E-02 DAV: 11 -0.350577099886E+03 -0.11003E-04 -0.10221E-04 7568 0.201E-02 0.401E-02 DAV: 12 -0.350577092475E+03 0.74105E-05 -0.43561E-05 6544 0.147E-02 87 F= -.35057709E+03 E0= -.35055875E+03 d E =-.191927E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350576351620E+03 0.74827E-03 -0.53031E-01 10964 0.159E+00 0.238E-01 DAV: 2 -0.350586536467E+03 -0.10185E-01 -0.44474E-02 15472 0.468E-01 0.140E+00 DAV: 3 -0.350575036954E+03 0.11500E-01 -0.41718E-02 14364 0.425E-01 0.290E-01 DAV: 4 -0.350577681816E+03 -0.26449E-02 -0.54770E-03 12592 0.157E-01 0.238E-01 DAV: 5 -0.350577527604E+03 0.15421E-03 -0.16968E-03 13344 0.958E-02 0.114E-01 DAV: 6 -0.350577513680E+03 0.13923E-04 -0.48236E-04 12224 0.440E-02 0.710E-02 DAV: 7 -0.350577522035E+03 -0.83547E-05 -0.17940E-04 9072 0.327E-02 0.605E-02 DAV: 8 -0.350577517976E+03 0.40591E-05 -0.13767E-04 9776 0.269E-02 0.507E-02 DAV: 9 -0.350577514940E+03 0.30357E-05 -0.10714E-04 7848 0.260E-02 0.484E-02 DAV: 10 -0.350577503095E+03 0.11845E-04 -0.57165E-05 6424 0.176E-02 0.127E-02 DAV: 11 -0.350577507555E+03 -0.44606E-05 -0.16121E-05 6464 0.109E-02 88 F= -.35057751E+03 E0= -.35055917E+03 d E =-.233435E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350572568402E+03 0.49347E-02 -0.21200E+00 10952 0.319E+00 0.476E-01 DAV: 2 -0.350612819130E+03 -0.40251E-01 -0.17585E-01 15464 0.935E-01 0.274E+00 DAV: 3 -0.350568510190E+03 0.44309E-01 -0.18267E-01 14648 0.842E-01 0.585E-01 DAV: 4 -0.350577808862E+03 -0.92987E-02 -0.22476E-02 12636 0.313E-01 0.464E-01 DAV: 5 -0.350577228656E+03 0.58021E-03 -0.64464E-03 12760 0.189E-01 0.212E-01 DAV: 6 -0.350577207875E+03 0.20781E-04 -0.19329E-03 13080 0.845E-02 0.143E-01 DAV: 7 -0.350577227918E+03 -0.20043E-04 -0.82114E-04 13312 0.637E-02 0.127E-01 DAV: 8 -0.350577207718E+03 0.20201E-04 -0.63104E-04 12328 0.511E-02 0.109E-01 DAV: 9 -0.350577187728E+03 0.19990E-04 -0.48337E-04 11624 0.485E-02 0.955E-02 DAV: 10 -0.350577147856E+03 0.39872E-04 -0.27751E-04 10808 0.329E-02 0.376E-02 DAV: 11 -0.350577161225E+03 -0.13369E-04 -0.99898E-05 7808 0.207E-02 0.397E-02 DAV: 12 -0.350577154037E+03 0.71879E-05 -0.34831E-05 6456 0.152E-02 89 F= -.35057715E+03 E0= -.35055883E+03 d E =-.198083E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350575067099E+03 0.20941E-02 -0.11722E+00 10928 0.237E+00 0.358E-01 DAV: 2 -0.350597693154E+03 -0.22626E-01 -0.92218E-02 15416 0.691E-01 0.204E+00 DAV: 3 -0.350572690462E+03 0.25003E-01 -0.51520E-02 14704 0.629E-01 0.419E-01 DAV: 4 -0.350578039330E+03 -0.53489E-02 -0.11722E-02 12824 0.231E-01 0.369E-01 DAV: 5 -0.350577660462E+03 0.37887E-03 -0.42739E-03 13152 0.149E-01 0.195E-01 DAV: 6 -0.350577584880E+03 0.75581E-04 -0.11545E-03 12768 0.704E-02 0.104E-01 DAV: 7 -0.350577611934E+03 -0.27054E-04 -0.37608E-04 11416 0.493E-02 0.850E-02 DAV: 8 -0.350577607450E+03 0.44841E-05 -0.33285E-04 11848 0.399E-02 0.786E-02 DAV: 9 -0.350577605568E+03 0.18815E-05 -0.36668E-04 10360 0.393E-02 0.891E-02 DAV: 10 -0.350577565501E+03 0.40067E-04 -0.19867E-04 9096 0.254E-02 0.215E-02 DAV: 11 -0.350577578166E+03 -0.12665E-04 -0.51052E-05 6824 0.163E-02 0.303E-02 DAV: 12 -0.350577573468E+03 0.46988E-05 -0.27898E-05 6208 0.124E-02 90 F= -.35057757E+03 E0= -.35055925E+03 d E =-.240026E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350575329929E+03 0.22482E-02 -0.16905E+00 10992 0.285E+00 0.424E-01 DAV: 2 -0.350608148830E+03 -0.32819E-01 -0.14518E-01 15560 0.844E-01 0.248E+00 DAV: 3 -0.350571863227E+03 0.36286E-01 -0.14329E-01 14720 0.781E-01 0.537E-01 DAV: 4 -0.350579374683E+03 -0.75115E-02 -0.17820E-02 12460 0.278E-01 0.397E-01 DAV: 5 -0.350579095803E+03 0.27888E-03 -0.50120E-03 12520 0.169E-01 0.206E-01 DAV: 6 -0.350578999295E+03 0.96507E-04 -0.15763E-03 13120 0.743E-02 0.115E-01 DAV: 7 -0.350579051340E+03 -0.52045E-04 -0.62783E-04 12280 0.581E-02 0.116E-01 DAV: 8 -0.350579023922E+03 0.27417E-04 -0.58632E-04 12240 0.481E-02 0.980E-02 DAV: 9 -0.350579001052E+03 0.22870E-04 -0.30203E-04 11312 0.401E-02 0.748E-02 DAV: 10 -0.350578979208E+03 0.21845E-04 -0.14743E-04 9664 0.279E-02 0.279E-02 DAV: 11 -0.350578988446E+03 -0.92380E-05 -0.64560E-05 6776 0.178E-02 91 F= -.35057899E+03 E0= -.35056078E+03 d E =-.141498E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350576943783E+03 0.20354E-02 -0.11504E+00 10992 0.235E+00 0.348E-01 DAV: 2 -0.350599255029E+03 -0.22311E-01 -0.96200E-02 15544 0.695E-01 0.205E+00 DAV: 3 -0.350574419007E+03 0.24836E-01 -0.94451E-02 14664 0.645E-01 0.442E-01 DAV: 4 -0.350579722495E+03 -0.53035E-02 -0.12008E-02 12428 0.229E-01 0.329E-01 DAV: 5 -0.350579529517E+03 0.19298E-03 -0.34490E-03 12712 0.139E-01 0.172E-01 DAV: 6 -0.350579461555E+03 0.67963E-04 -0.10940E-03 13056 0.616E-02 0.959E-02 DAV: 7 -0.350579502926E+03 -0.41372E-04 -0.44082E-04 11112 0.485E-02 0.992E-02 DAV: 8 -0.350579480429E+03 0.22497E-04 -0.40181E-04 11584 0.401E-02 0.799E-02 DAV: 9 -0.350579470590E+03 0.98384E-05 -0.21306E-04 10304 0.341E-02 0.658E-02 DAV: 10 -0.350579452997E+03 0.17593E-04 -0.11990E-04 8560 0.240E-02 0.260E-02 DAV: 11 -0.350579459621E+03 -0.66236E-05 -0.52852E-05 6408 0.158E-02 92 F= -.35057946E+03 E0= -.35056135E+03 d E =-.188615E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.350578900297E+03 0.55270E-03 -0.89954E-01 10804 0.208E+00 0.292E-01 DAV: 2 -0.350593956045E+03 -0.15056E-01 -0.68805E-02 14840 0.589E-01 0.166E+00 DAV: 3 -0.350577663376E+03 0.16293E-01 -0.56553E-02 14656 0.522E-01 0.340E-01 DAV: 4 -0.350581353645E+03 -0.36903E-02 -0.85694E-03 12904 0.196E-01 0.325E-01 DAV: 5 -0.350581035533E+03 0.31811E-03 -0.32732E-03 12968 0.129E-01 0.165E-01 DAV: 6 -0.350580984826E+03 0.50708E-04 -0.87503E-04 12720 0.544E-02 0.781E-02 DAV: 7 -0.350581045459E+03 -0.60633E-04 -0.39599E-04 11272 0.473E-02 0.976E-02 DAV: 8 -0.350581013867E+03 0.31592E-04 -0.46781E-04 11352 0.358E-02 0.717E-02 DAV: 9 -0.350581006921E+03 0.69460E-05 -0.20988E-04 9336 0.316E-02 0.559E-02 DAV: 10 -0.350580995995E+03 0.10927E-04 -0.11694E-04 7664 0.208E-02 0.246E-02 DAV: 11 -0.350581000433E+03 -0.44388E-05 -0.39153E-05 6504 0.152E-02