N E dE d eps ncg rms rms(c)
DAV: 1 0.151890925596E+04 0.15189E+04 -0.63582E+04 27084 0.114E+03
DAV: 2 -0.491739633631E+02 -0.15681E+04 -0.15151E+04 38844 0.264E+02
DAV: 3 -0.376033485235E+03 -0.32686E+03 -0.32473E+03 31464 0.128E+02
DAV: 4 -0.388865561892E+03 -0.12832E+02 -0.12736E+02 30816 0.308E+01
DAV: 5 -0.389242955425E+03 -0.37739E+00 -0.37625E+00 34200 0.484E+00 0.307E+01
DAV: 6 -0.366245544256E+03 0.22997E+02 -0.52453E+01 29394 0.209E+01 0.171E+01
DAV: 7 -0.361676525772E+03 0.45690E+01 -0.14081E+01 32244 0.129E+01 0.905E+00
DAV: 8 -0.360333145935E+03 0.13434E+01 -0.43741E+00 30912 0.616E+00 0.403E+00
DAV: 9 -0.360386226396E+03 -0.53080E-01 -0.24257E+00 33516 0.448E+00 0.290E+00
DAV: 10 -0.360227953165E+03 0.15827E+00 -0.35573E-01 34008 0.231E+00 0.150E+00
DAV: 11 -0.360169660896E+03 0.58292E-01 -0.17628E-01 31476 0.153E+00 0.948E-01
DAV: 12 -0.360151093575E+03 0.18567E-01 -0.99960E-02 34044 0.115E+00 0.431E-01
DAV: 13 -0.360156830130E+03 -0.57366E-02 -0.25170E-02 28296 0.556E-01 0.291E-01
DAV: 14 -0.360164345968E+03 -0.75158E-02 -0.10690E-02 30432 0.333E-01 0.357E-01
DAV: 15 -0.360172801876E+03 -0.84559E-02 -0.12865E-02 36744 0.410E-01 0.631E-01
DAV: 16 -0.360173542963E+03 -0.74109E-03 -0.36800E-03 30732 0.217E-01 0.840E-02
DAV: 17 -0.360178645503E+03 -0.51025E-02 -0.26973E-03 28746 0.146E-01 0.162E-01
DAV: 18 -0.360181813869E+03 -0.31684E-02 -0.96102E-04 33072 0.109E-01 0.930E-02
DAV: 19 -0.360184999464E+03 -0.31856E-02 -0.37846E-04 30258 0.617E-02 0.609E-02
DAV: 20 -0.360186915111E+03 -0.19156E-02 -0.32767E-04 32052 0.584E-02 0.585E-02
DAV: 21 -0.360187440551E+03 -0.52544E-03 -0.11430E-04 31908 0.426E-02 0.307E-02
DAV: 22 -0.360188092315E+03 -0.65176E-03 -0.10587E-04 26724 0.264E-02 0.972E-03
DAV: 23 -0.360188261845E+03 -0.16953E-03 -0.23255E-05 25368 0.120E-02 0.416E-03
DAV: 24 -0.360188387620E+03 -0.12578E-03 -0.18286E-05 22566 0.974E-03 0.402E-03
DAV: 25 -0.360188419767E+03 -0.32147E-04 -0.44123E-06 22488 0.558E-03 0.486E-03
DAV: 26 -0.360188437018E+03 -0.17251E-04 -0.24732E-06 20340 0.353E-03 0.349E-03
DAV: 27 -0.360188446643E+03 -0.96244E-05 -0.16569E-06 20196 0.319E-03
1 F= -.36018845E+03 E0= -.36019824E+03 d E =-.360188E+03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.198152698566E+03 0.16204E+03 -0.56906E+03 26880 0.240E+02 0.102E+02
DAV: 2 -0.245763507423E+03 -0.47611E+02 -0.55520E+02 32064 0.662E+01 0.425E+01
DAV: 3 -0.237094920362E+03 0.86686E+01 -0.36123E+01 30924 0.231E+01 0.129E+01
DAV: 4 -0.236954872009E+03 0.14005E+00 -0.70648E+00 31572 0.882E+00 0.764E+00
DAV: 5 -0.236813159546E+03 0.14171E+00 -0.17788E+00 29388 0.558E+00 0.260E+00
DAV: 6 -0.236771469987E+03 0.41690E-01 -0.31496E-01 31962 0.202E+00 0.107E+00
DAV: 7 -0.236761147840E+03 0.10322E-01 -0.86709E-02 30864 0.972E-01 0.452E-01
DAV: 8 -0.236761301770E+03 -0.15393E-03 -0.36569E-02 32736 0.420E-01 0.328E-01
DAV: 9 -0.236764219551E+03 -0.29178E-02 -0.74340E-03 26988 0.326E-01 0.122E-01
DAV: 10 -0.236767374894E+03 -0.31553E-02 -0.33882E-03 31236 0.219E-01 0.117E-01
DAV: 11 -0.236771240796E+03 -0.38659E-02 -0.19893E-03 27264 0.180E-01 0.488E-02
DAV: 12 -0.236772801454E+03 -0.15607E-02 -0.50921E-04 32040 0.767E-02 0.376E-02
DAV: 13 -0.236774298544E+03 -0.14971E-02 -0.34321E-04 27444 0.542E-02 0.230E-02
DAV: 14 -0.236774938676E+03 -0.64013E-03 -0.87138E-05 29868 0.250E-02 0.147E-02
DAV: 15 -0.236775472518E+03 -0.53384E-03 -0.93756E-05 26418 0.283E-02 0.845E-03
DAV: 16 -0.236775669362E+03 -0.19684E-03 -0.20988E-05 22716 0.122E-02 0.483E-03
DAV: 17 -0.236775796935E+03 -0.12757E-03 -0.14565E-05 19860 0.960E-03 0.420E-03
DAV: 18 -0.236775857066E+03 -0.60131E-04 -0.58106E-06 19140 0.546E-03 0.205E-03
DAV: 19 -0.236775881183E+03 -0.24117E-04 -0.33780E-06 18792 0.377E-03 0.979E-04
DAV: 20 -0.236775894063E+03 -0.12881E-04 -0.19122E-06 18504 0.292E-03 0.120E-03
DAV: 21 -0.236775897255E+03 -0.31917E-05 -0.78776E-07 19440 0.179E-03
2 F= -.23677590E+03 E0= -.23678401E+03 d E =0.123413E+03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.338460386505E+03 -0.10168E+03 -0.49427E+03 26964 0.221E+02 0.633E+01
DAV: 2 -0.374606139072E+03 -0.36146E+02 -0.53777E+02 34248 0.556E+01 0.471E+01
DAV: 3 -0.361485228746E+03 0.13121E+02 -0.53914E+01 38088 0.276E+01 0.290E+01
DAV: 4 -0.368770361105E+03 -0.72851E+01 -0.79517E+01 30912 0.257E+01 0.213E+01
DAV: 5 -0.361394552362E+03 0.73758E+01 -0.26155E+01 32136 0.124E+01 0.763E+00
DAV: 6 -0.361108700065E+03 0.28585E+00 -0.10139E+01 29520 0.940E+00 0.355E+00
DAV: 7 -0.360942934154E+03 0.16577E+00 -0.12762E+00 29556 0.398E+00 0.232E+00
DAV: 8 -0.360848200332E+03 0.94734E-01 -0.43730E-01 34404 0.220E+00 0.118E+00
DAV: 9 -0.360809717750E+03 0.38483E-01 -0.72297E-02 33648 0.117E+00 0.807E-01
DAV: 10 -0.360778753258E+03 0.30964E-01 -0.37685E-02 36636 0.109E+00 0.594E-01
DAV: 11 -0.360756136081E+03 0.22617E-01 -0.32328E-02 34572 0.982E-01 0.398E-01
DAV: 12 -0.360758794558E+03 -0.26585E-02 -0.68976E-02 35544 0.953E-01 0.108E+00
DAV: 13 -0.360751414912E+03 0.73796E-02 -0.16919E-02 29526 0.501E-01 0.268E-01
DAV: 14 -0.360753183868E+03 -0.17690E-02 -0.25045E-03 29412 0.219E-01 0.487E-01
DAV: 15 -0.360754342025E+03 -0.11582E-02 -0.13909E-02 35262 0.434E-01 0.330E-01
DAV: 16 -0.360753803069E+03 0.53896E-03 -0.37400E-03 30888 0.217E-01 0.240E-01
DAV: 17 -0.360753763329E+03 0.39740E-04 -0.18248E-03 38700 0.203E-01 0.905E-02
DAV: 18 -0.360754643006E+03 -0.87968E-03 -0.74039E-04 29166 0.913E-02 0.851E-02
DAV: 19 -0.360754931372E+03 -0.28837E-03 -0.24447E-04 31812 0.487E-02 0.206E-02
DAV: 20 -0.360755291126E+03 -0.35975E-03 -0.70067E-05 30330 0.258E-02 0.160E-02
DAV: 21 -0.360755504131E+03 -0.21300E-03 -0.45841E-05 27396 0.285E-02 0.309E-02
DAV: 22 -0.360755625389E+03 -0.12126E-03 -0.33787E-05 23964 0.248E-02 0.115E-02
DAV: 23 -0.360755679624E+03 -0.54235E-04 -0.11534E-05 22200 0.892E-03 0.596E-03
DAV: 24 -0.360755714139E+03 -0.34515E-04 -0.77049E-06 21582 0.102E-02 0.115E-02
DAV: 25 -0.360755728186E+03 -0.14047E-04 -0.29057E-06 21084 0.501E-03 0.600E-03
DAV: 26 -0.360755736624E+03 -0.84375E-05 -0.22989E-06 20382 0.578E-03
3 F= -.36075574E+03 E0= -.36076946E+03 d E =-.567290E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.361848638534E+03 -0.10929E+01 -0.11499E+01 25668 0.107E+01 0.924E-01
DAV: 2 -0.361877345893E+03 -0.28707E-01 -0.41639E-01 32184 0.179E+00 0.526E-01
DAV: 3 -0.361881450282E+03 -0.41044E-02 -0.95295E-03 29856 0.368E-01 0.355E-01
DAV: 4 -0.361878925487E+03 0.25248E-02 -0.29421E-03 29196 0.268E-01 0.245E-01
DAV: 5 -0.361874001490E+03 0.49240E-02 -0.76223E-03 34596 0.408E-01 0.160E-01
DAV: 6 -0.361873181956E+03 0.81953E-03 -0.35817E-03 32856 0.238E-01 0.108E-01
DAV: 7 -0.361872675845E+03 0.50611E-03 -0.10126E-03 35232 0.145E-01 0.541E-02
DAV: 8 -0.361872244388E+03 0.43146E-03 -0.41933E-04 31224 0.126E-01 0.330E-02
DAV: 9 -0.361872140991E+03 0.10340E-03 -0.25302E-04 35232 0.780E-02 0.312E-02
DAV: 10 -0.361872133256E+03 0.77348E-05 -0.10805E-04 33600 0.593E-02 0.979E-03
DAV: 11 -0.361872167057E+03 -0.33801E-04 -0.72078E-05 29892 0.482E-02 0.132E-02
DAV: 12 -0.361872235431E+03 -0.68373E-04 -0.47762E-05 29772 0.280E-02 0.133E-02
DAV: 13 -0.361872291012E+03 -0.55581E-04 -0.14108E-05 20430 0.151E-02 0.330E-03
DAV: 14 -0.361872324344E+03 -0.33332E-04 -0.47136E-06 21300 0.714E-03 0.215E-03
DAV: 15 -0.361872365510E+03 -0.41167E-04 -0.38563E-06 20280 0.607E-03 0.312E-03
DAV: 16 -0.361872385087E+03 -0.19577E-04 -0.23153E-06 21336 0.426E-03 0.105E-03
DAV: 17 -0.361872396865E+03 -0.11777E-04 -0.13804E-06 20934 0.242E-03 0.988E-04
DAV: 18 -0.361872403769E+03 -0.69040E-05 -0.82105E-07 20670 0.175E-03
4 F= -.36187240E+03 E0= -.36188607E+03 d E =-.168396E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360899343517E+03 0.97305E+00 -0.64405E+02 25536 0.820E+01 0.836E+00
DAV: 2 -0.363285804638E+03 -0.23865E+01 -0.27114E+01 29508 0.140E+01 0.457E+00
DAV: 3 -0.363022308230E+03 0.26350E+00 -0.88332E-01 31896 0.318E+00 0.269E+00
DAV: 4 -0.362906925516E+03 0.11538E+00 -0.40818E-01 30204 0.238E+00 0.633E-01
DAV: 5 -0.362908928560E+03 -0.20030E-02 -0.83963E-02 29976 0.955E-01 0.315E-01
DAV: 6 -0.362908700099E+03 0.22846E-03 -0.11350E-02 31704 0.366E-01 0.160E-01
DAV: 7 -0.362909369809E+03 -0.66971E-03 -0.22956E-03 28524 0.197E-01 0.765E-02
DAV: 8 -0.362910200752E+03 -0.83094E-03 -0.39808E-04 28584 0.822E-02 0.348E-02
DAV: 9 -0.362910927026E+03 -0.72627E-03 -0.25659E-04 30144 0.683E-02 0.210E-02
DAV: 10 -0.362911468058E+03 -0.54103E-03 -0.11986E-04 30012 0.455E-02 0.148E-02
DAV: 11 -0.362911787231E+03 -0.31917E-03 -0.72436E-05 29964 0.319E-02 0.794E-03
DAV: 12 -0.362911954985E+03 -0.16775E-03 -0.19120E-05 22416 0.159E-02 0.431E-03
DAV: 13 -0.362912062373E+03 -0.10739E-03 -0.14897E-05 20952 0.103E-02 0.289E-03
DAV: 14 -0.362912107951E+03 -0.45578E-04 -0.44952E-06 20376 0.578E-03 0.141E-03
DAV: 15 -0.362912138092E+03 -0.30141E-04 -0.36639E-06 19020 0.432E-03 0.171E-03
DAV: 16 -0.362912149314E+03 -0.11222E-04 -0.14648E-06 20520 0.314E-03 0.732E-04
DAV: 17 -0.362912155260E+03 -0.59459E-05 -0.12005E-06 18972 0.260E-03
5 F= -.36291216E+03 E0= -.36291603E+03 d E =-.272371E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.363804857328E+03 -0.89271E+00 -0.18341E+02 25536 0.435E+01 0.388E+00
DAV: 2 -0.364404731146E+03 -0.59987E+00 -0.73671E+00 31980 0.740E+00 0.258E+00
DAV: 3 -0.364313255896E+03 0.91475E-01 -0.21340E-01 30528 0.173E+00 0.156E+00
DAV: 4 -0.364292032159E+03 0.21224E-01 -0.13406E-01 29928 0.120E+00 0.542E-01
DAV: 5 -0.364290995622E+03 0.10365E-02 -0.27724E-02 28968 0.528E-01 0.184E-01
DAV: 6 -0.364291166865E+03 -0.17124E-03 -0.22081E-03 32844 0.178E-01 0.104E-01
DAV: 7 -0.364291735262E+03 -0.56840E-03 -0.80912E-04 30438 0.102E-01 0.434E-02
DAV: 8 -0.364292138286E+03 -0.40302E-03 -0.13255E-04 30996 0.440E-02 0.215E-02
DAV: 9 -0.364292520507E+03 -0.38222E-03 -0.59102E-05 27600 0.253E-02 0.904E-03
DAV: 10 -0.364292827853E+03 -0.30735E-03 -0.39975E-05 27996 0.219E-02 0.813E-03
DAV: 11 -0.364293060666E+03 -0.23281E-03 -0.38926E-05 26082 0.202E-02 0.418E-03
DAV: 12 -0.364293146329E+03 -0.85664E-04 -0.12797E-05 23400 0.104E-02 0.254E-03
DAV: 13 -0.364293181789E+03 -0.35460E-04 -0.47878E-06 21720 0.584E-03 0.180E-03
DAV: 14 -0.364293201649E+03 -0.19860E-04 -0.25104E-06 21498 0.379E-03 0.946E-04
DAV: 15 -0.364293213501E+03 -0.11852E-04 -0.18005E-06 21408 0.279E-03 0.797E-04
DAV: 16 -0.364293218757E+03 -0.52557E-05 -0.79708E-07 21960 0.216E-03
6 F= -.36429322E+03 E0= -.36429709E+03 d E =-.410477E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.364418779810E+03 -0.12557E+00 -0.16514E+01 25536 0.131E+01 0.115E+00
DAV: 2 -0.364468300155E+03 -0.49520E-01 -0.58470E-01 29508 0.214E+00 0.706E-01
DAV: 3 -0.364462053522E+03 0.62466E-02 -0.17827E-02 32136 0.465E-01 0.409E-01
DAV: 4 -0.364460261585E+03 0.17919E-02 -0.83851E-03 29448 0.325E-01 0.989E-02
DAV: 5 -0.364460298184E+03 -0.36599E-04 -0.15031E-03 30996 0.123E-01 0.440E-02
DAV: 6 -0.364460327700E+03 -0.29516E-04 -0.15157E-04 31896 0.410E-02 0.238E-02
DAV: 7 -0.364460368873E+03 -0.41172E-04 -0.32376E-05 28242 0.225E-02 0.115E-02
DAV: 8 -0.364460408757E+03 -0.39884E-04 -0.64301E-06 20256 0.109E-02 0.466E-03
DAV: 9 -0.364460444413E+03 -0.35657E-04 -0.71082E-06 20154 0.940E-03 0.358E-03
DAV: 10 -0.364460473408E+03 -0.28995E-04 -0.38714E-06 20118 0.767E-03 0.199E-03
DAV: 11 -0.364460487293E+03 -0.13885E-04 -0.21427E-06 20760 0.470E-03 0.124E-03
DAV: 12 -0.364460494515E+03 -0.72218E-05 -0.93832E-07 20376 0.259E-03
7 F= -.36446049E+03 E0= -.36446437E+03 d E =-.427205E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.361622543952E+03 0.28379E+01 -0.77294E+02 25548 0.898E+01 0.793E+00
DAV: 2 -0.364085430453E+03 -0.24629E+01 -0.31433E+01 28332 0.157E+01 0.479E+00
DAV: 3 -0.363865640087E+03 0.21979E+00 -0.10936E+00 29592 0.356E+00 0.292E+00
DAV: 4 -0.363785132503E+03 0.80508E-01 -0.42411E-01 31572 0.237E+00 0.127E+00
DAV: 5 -0.363770650542E+03 0.14482E-01 -0.79943E-02 29556 0.102E+00 0.477E-01
DAV: 6 -0.363770312575E+03 0.33797E-03 -0.30655E-02 28140 0.629E-01 0.230E-01
DAV: 7 -0.363771045680E+03 -0.73311E-03 -0.38953E-03 31356 0.229E-01 0.129E-01
DAV: 8 -0.363772165873E+03 -0.11202E-02 -0.12782E-03 29028 0.138E-01 0.594E-02
DAV: 9 -0.363773225758E+03 -0.10599E-02 -0.40977E-04 32538 0.978E-02 0.269E-02
DAV: 10 -0.363774401235E+03 -0.11755E-02 -0.35886E-04 30744 0.844E-02 0.216E-02
DAV: 11 -0.363775262739E+03 -0.86150E-03 -0.23791E-04 29412 0.620E-02 0.126E-02
DAV: 12 -0.363775646284E+03 -0.38355E-03 -0.10522E-04 31572 0.318E-02 0.847E-03
DAV: 13 -0.363775797877E+03 -0.15159E-03 -0.13379E-05 22296 0.109E-02 0.438E-03
DAV: 14 -0.363775935726E+03 -0.13785E-03 -0.21178E-05 24000 0.967E-03 0.298E-03
DAV: 15 -0.363775978631E+03 -0.42905E-04 -0.28719E-06 21840 0.449E-03 0.201E-03
DAV: 16 -0.363776021093E+03 -0.42462E-04 -0.49385E-06 19806 0.424E-03 0.138E-03
DAV: 17 -0.363776036236E+03 -0.15143E-04 -0.18568E-06 21120 0.300E-03 0.787E-04
DAV: 18 -0.363776042987E+03 -0.67514E-05 -0.11421E-06 20604 0.261E-03
8 F= -.36377604E+03 E0= -.36377991E+03 d E =0.684452E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.364737882492E+03 -0.96185E+00 -0.25227E+02 25536 0.513E+01 0.389E+00
DAV: 2 -0.365497917643E+03 -0.76004E+00 -0.91872E+00 29520 0.849E+00 0.272E+00
DAV: 3 -0.365428027050E+03 0.69891E-01 -0.32997E-01 30912 0.197E+00 0.163E+00
DAV: 4 -0.365400676231E+03 0.27351E-01 -0.96691E-02 30012 0.115E+00 0.718E-01
DAV: 5 -0.365396742250E+03 0.39340E-02 -0.28853E-02 31812 0.582E-01 0.239E-01
DAV: 6 -0.365396579015E+03 0.16323E-03 -0.62194E-03 29364 0.283E-01 0.129E-01
DAV: 7 -0.365396658874E+03 -0.79859E-04 -0.95014E-04 31920 0.118E-01 0.631E-02
DAV: 8 -0.365396952685E+03 -0.29381E-03 -0.35564E-04 29568 0.770E-02 0.239E-02
DAV: 9 -0.365397186148E+03 -0.23346E-03 -0.84488E-05 31932 0.471E-02 0.154E-02
DAV: 10 -0.365397447988E+03 -0.26184E-03 -0.64007E-05 28170 0.366E-02 0.116E-02
DAV: 11 -0.365397691350E+03 -0.24336E-03 -0.47100E-05 28458 0.353E-02 0.569E-03
DAV: 12 -0.365397802178E+03 -0.11083E-03 -0.33572E-05 27828 0.197E-02 0.512E-03
DAV: 13 -0.365397833893E+03 -0.31715E-04 -0.33208E-06 22452 0.672E-03 0.314E-03
DAV: 14 -0.365397890989E+03 -0.57096E-04 -0.58549E-06 19806 0.676E-03 0.186E-03
DAV: 15 -0.365397914450E+03 -0.23461E-04 -0.21510E-06 21720 0.363E-03 0.189E-03
DAV: 16 -0.365397928079E+03 -0.13629E-04 -0.10524E-06 21264 0.322E-03 0.755E-04
DAV: 17 -0.365397940735E+03 -0.12656E-04 -0.15964E-06 19932 0.274E-03 0.826E-04
DAV: 18 -0.365397943264E+03 -0.25292E-05 -0.41456E-07 21924 0.152E-03
9 F= -.36539794E+03 E0= -.36540181E+03 d E =-.937449E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.364222775021E+03 0.11752E+01 -0.28654E+02 25536 0.554E+01 0.446E+00
DAV: 2 -0.364995677451E+03 -0.77290E+00 -0.95518E+00 28164 0.890E+00 0.290E+00
DAV: 3 -0.364905939995E+03 0.89737E-01 -0.34614E-01 33336 0.208E+00 0.175E+00
DAV: 4 -0.364862366986E+03 0.43573E-01 -0.11409E-01 30552 0.136E+00 0.627E-01
DAV: 5 -0.364860071102E+03 0.22959E-02 -0.36244E-02 32256 0.653E-01 0.255E-01
DAV: 6 -0.364860312583E+03 -0.24148E-03 -0.55449E-03 29964 0.265E-01 0.141E-01
DAV: 7 -0.364860804839E+03 -0.49226E-03 -0.91837E-04 32088 0.124E-01 0.623E-02
DAV: 8 -0.364861735348E+03 -0.93051E-03 -0.54981E-04 29646 0.980E-02 0.311E-02
DAV: 9 -0.364862342956E+03 -0.60761E-03 -0.18428E-04 32748 0.632E-02 0.235E-02
DAV: 10 -0.364863059528E+03 -0.71657E-03 -0.17919E-04 29484 0.607E-02 0.150E-02
DAV: 11 -0.364863538241E+03 -0.47871E-03 -0.15373E-04 32028 0.482E-02 0.889E-03
DAV: 12 -0.364863713152E+03 -0.17491E-03 -0.41632E-05 31740 0.198E-02 0.846E-03
DAV: 13 -0.364863816952E+03 -0.10380E-03 -0.11968E-05 22854 0.956E-03 0.364E-03
DAV: 14 -0.364863911120E+03 -0.94168E-04 -0.15530E-05 23544 0.887E-03 0.313E-03
DAV: 15 -0.364863937727E+03 -0.26607E-04 -0.22633E-06 22524 0.425E-03 0.185E-03
DAV: 16 -0.364863965042E+03 -0.27315E-04 -0.40630E-06 21144 0.439E-03 0.887E-04
DAV: 17 -0.364863973498E+03 -0.84563E-05 -0.13667E-06 21936 0.243E-03
10 F= -.36486397E+03 E0= -.36486784E+03 d E =0.533970E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.365429051972E+03 -0.56509E+00 -0.10997E+02 25536 0.347E+01 0.270E+00
DAV: 2 -0.365737862654E+03 -0.30881E+00 -0.38536E+00 29172 0.561E+00 0.187E+00
DAV: 3 -0.365698725994E+03 0.39137E-01 -0.13260E-01 33312 0.136E+00 0.117E+00
DAV: 4 -0.365681786689E+03 0.16939E-01 -0.70381E-02 28920 0.104E+00 0.450E-01
DAV: 5 -0.365680369096E+03 0.14176E-02 -0.15950E-02 32520 0.442E-01 0.208E-01
DAV: 6 -0.365680102838E+03 0.26626E-03 -0.36966E-03 29172 0.209E-01 0.108E-01
DAV: 7 -0.365680164194E+03 -0.61356E-04 -0.55754E-04 30756 0.102E-01 0.503E-02
DAV: 8 -0.365680436621E+03 -0.27243E-03 -0.21101E-04 30540 0.600E-02 0.213E-02
DAV: 9 -0.365680668731E+03 -0.23211E-03 -0.56999E-05 30384 0.393E-02 0.142E-02
DAV: 10 -0.365681047763E+03 -0.37903E-03 -0.66265E-05 26334 0.423E-02 0.105E-02
DAV: 11 -0.365681294262E+03 -0.24650E-03 -0.63610E-05 28728 0.343E-02 0.555E-03
DAV: 12 -0.365681388782E+03 -0.94520E-04 -0.22284E-05 27420 0.149E-02 0.524E-03
DAV: 13 -0.365681441573E+03 -0.52791E-04 -0.40923E-06 20784 0.669E-03 0.228E-03
DAV: 14 -0.365681496205E+03 -0.54632E-04 -0.63640E-06 21852 0.557E-03 0.190E-03
DAV: 15 -0.365681508729E+03 -0.12524E-04 -0.10160E-06 22404 0.358E-03 0.925E-04
DAV: 16 -0.365681523840E+03 -0.15111E-04 -0.14026E-06 19812 0.273E-03 0.115E-03
DAV: 17 -0.365681527644E+03 -0.38043E-05 -0.45304E-07 21600 0.194E-03
11 F= -.36568153E+03 E0= -.36568540E+03 d E =-.283584E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.365667479340E+03 0.14045E-01 -0.11732E+02 25536 0.362E+01 0.263E+00
DAV: 2 -0.365906989770E+03 -0.23951E+00 -0.31257E+00 28968 0.522E+00 0.158E+00
DAV: 3 -0.365875020527E+03 0.31969E-01 -0.10026E-01 33600 0.127E+00 0.911E-01
DAV: 4 -0.365868277772E+03 0.67428E-02 -0.66807E-02 30624 0.925E-01 0.310E-01
DAV: 5 -0.365868013811E+03 0.26396E-03 -0.10456E-02 33624 0.409E-01 0.153E-01
DAV: 6 -0.365868123552E+03 -0.10974E-03 -0.21922E-03 30624 0.152E-01 0.748E-02
DAV: 7 -0.365868200803E+03 -0.77251E-04 -0.37435E-04 29760 0.764E-02 0.301E-02
DAV: 8 -0.365868334138E+03 -0.13334E-03 -0.61629E-05 29520 0.301E-02 0.157E-02
DAV: 9 -0.365868505457E+03 -0.17132E-03 -0.44176E-05 29100 0.292E-02 0.853E-03
DAV: 10 -0.365868709270E+03 -0.20381E-03 -0.27048E-05 24978 0.227E-02 0.794E-03
DAV: 11 -0.365868825956E+03 -0.11669E-03 -0.17226E-05 22236 0.149E-02 0.426E-03
DAV: 12 -0.365868885578E+03 -0.59622E-04 -0.58405E-06 20892 0.746E-03 0.215E-03
DAV: 13 -0.365868926031E+03 -0.40453E-04 -0.33940E-06 20094 0.441E-03 0.133E-03
DAV: 14 -0.365868945603E+03 -0.19572E-04 -0.15254E-06 20796 0.271E-03 0.938E-04
DAV: 15 -0.365868959334E+03 -0.13731E-04 -0.12404E-06 19866 0.236E-03 0.522E-04
DAV: 16 -0.365868963494E+03 -0.41595E-05 -0.51887E-07 20868 0.152E-03
12 F= -.36586896E+03 E0= -.36587283E+03 d E =-.187436E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.365895473072E+03 -0.26514E-01 -0.10649E+01 25536 0.109E+01 0.819E-01
DAV: 2 -0.365917139943E+03 -0.21667E-01 -0.29949E-01 29592 0.161E+00 0.499E-01
DAV: 3 -0.365913944926E+03 0.31950E-02 -0.91508E-03 33120 0.401E-01 0.303E-01
DAV: 4 -0.365913294791E+03 0.65014E-03 -0.79706E-03 29610 0.321E-01 0.112E-01
DAV: 5 -0.365913249127E+03 0.45664E-04 -0.13085E-03 33564 0.148E-01 0.554E-02
DAV: 6 -0.365913289668E+03 -0.40541E-04 -0.29816E-04 30132 0.563E-02 0.248E-02
DAV: 7 -0.365913330664E+03 -0.40996E-04 -0.41205E-05 29658 0.252E-02 0.981E-03
DAV: 8 -0.365913373432E+03 -0.42768E-04 -0.74240E-06 20388 0.104E-02 0.533E-03
DAV: 9 -0.365913417702E+03 -0.44270E-04 -0.57469E-06 20094 0.971E-03 0.235E-03
DAV: 10 -0.365913472755E+03 -0.55053E-04 -0.82286E-06 19974 0.966E-03 0.349E-03
DAV: 11 -0.365913494048E+03 -0.21293E-04 -0.32727E-06 21564 0.558E-03 0.215E-03
DAV: 12 -0.365913505372E+03 -0.11323E-04 -0.19356E-06 20838 0.389E-03 0.782E-04
DAV: 13 -0.365913513463E+03 -0.80915E-05 -0.11509E-06 20886 0.235E-03
13 F= -.36591351E+03 E0= -.36591738E+03 d E =-.231986E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.365989814713E+03 -0.76309E-01 -0.57793E+01 25536 0.255E+01 0.191E+00
DAV: 2 -0.366085394479E+03 -0.95580E-01 -0.14347E+00 27960 0.363E+00 0.119E+00
DAV: 3 -0.366074275376E+03 0.11119E-01 -0.62991E-02 33528 0.915E-01 0.723E-01
DAV: 4 -0.366070846202E+03 0.34292E-02 -0.24979E-02 30096 0.588E-01 0.244E-01
DAV: 5 -0.366070601798E+03 0.24440E-03 -0.42282E-03 31800 0.253E-01 0.102E-01
DAV: 6 -0.366070630704E+03 -0.28906E-04 -0.13145E-03 29484 0.123E-01 0.551E-02
DAV: 7 -0.366070658031E+03 -0.27327E-04 -0.19521E-04 34224 0.611E-02 0.251E-02
DAV: 8 -0.366070718109E+03 -0.60078E-04 -0.50130E-05 30192 0.303E-02 0.115E-02
DAV: 9 -0.366070767088E+03 -0.48979E-04 -0.13641E-05 21180 0.193E-02 0.582E-03
DAV: 10 -0.366070848076E+03 -0.80988E-04 -0.17538E-05 21402 0.214E-02 0.580E-03
DAV: 11 -0.366070899840E+03 -0.51764E-04 -0.10550E-05 20868 0.156E-02 0.365E-03
DAV: 12 -0.366070926914E+03 -0.27074E-04 -0.69430E-06 21144 0.942E-03 0.223E-03
DAV: 13 -0.366070943153E+03 -0.16240E-04 -0.17637E-06 20634 0.417E-03 0.115E-03
DAV: 14 -0.366070956730E+03 -0.13577E-04 -0.13586E-06 20166 0.282E-03 0.722E-04
DAV: 15 -0.366070962436E+03 -0.57054E-05 -0.48395E-07 20988 0.169E-03
14 F= -.36607096E+03 E0= -.36607483E+03 d E =-.157449E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366076173058E+03 -0.52163E-02 -0.18622E+00 25536 0.457E+00 0.354E-01
DAV: 2 -0.366078994685E+03 -0.28216E-02 -0.45625E-02 28236 0.649E-01 0.207E-01
DAV: 3 -0.366078650016E+03 0.34467E-03 -0.19803E-03 32568 0.165E-01 0.123E-01
DAV: 4 -0.366078583539E+03 0.66477E-04 -0.86537E-04 30408 0.110E-01 0.411E-02
DAV: 5 -0.366078578664E+03 0.48744E-05 -0.13554E-04 32148 0.465E-02 0.187E-02
DAV: 6 -0.366078583671E+03 -0.50071E-05 -0.46041E-05 28830 0.230E-02
15 F= -.36607858E+03 E0= -.36608245E+03 d E =-.165070E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366161803628E+03 -0.83225E-01 -0.35721E+01 25536 0.199E+01 0.170E+00
DAV: 2 -0.366200153575E+03 -0.38350E-01 -0.85818E-01 28782 0.282E+00 0.941E-01
DAV: 3 -0.366190438497E+03 0.97151E-02 -0.55033E-02 31716 0.812E-01 0.502E-01
DAV: 4 -0.366187878014E+03 0.25605E-02 -0.10756E-02 32568 0.409E-01 0.207E-01
DAV: 5 -0.366187560806E+03 0.31721E-03 -0.24414E-03 30240 0.178E-01 0.679E-02
DAV: 6 -0.366187627720E+03 -0.66914E-04 -0.55670E-04 28680 0.801E-02 0.398E-02
DAV: 7 -0.366187707798E+03 -0.80077E-04 -0.88041E-05 29388 0.372E-02 0.190E-02
DAV: 8 -0.366187841858E+03 -0.13406E-03 -0.44955E-05 28698 0.230E-02 0.857E-03
DAV: 9 -0.366187949836E+03 -0.10798E-03 -0.93964E-06 21960 0.105E-02 0.531E-03
DAV: 10 -0.366188096389E+03 -0.14655E-03 -0.19299E-05 23934 0.116E-02 0.356E-03
DAV: 11 -0.366188180896E+03 -0.84507E-04 -0.93393E-06 22128 0.786E-03 0.195E-03
DAV: 12 -0.366188221288E+03 -0.40393E-04 -0.46897E-06 22170 0.492E-03 0.170E-03
DAV: 13 -0.366188238640E+03 -0.17352E-04 -0.13731E-06 20916 0.321E-03 0.699E-04
DAV: 14 -0.366188251127E+03 -0.12487E-04 -0.17627E-06 20010 0.257E-03 0.806E-04
DAV: 15 -0.366188254253E+03 -0.31263E-05 -0.53579E-07 21576 0.174E-03
16 F= -.36618825E+03 E0= -.36619212E+03 d E =-.109671E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366191119538E+03 -0.28684E-02 -0.76438E-01 25536 0.293E+00 0.252E-01
DAV: 2 -0.366191895072E+03 -0.77553E-03 -0.18856E-02 29580 0.418E-01 0.137E-01
DAV: 3 -0.366191696861E+03 0.19821E-03 -0.11411E-03 31896 0.118E-01 0.745E-02
DAV: 4 -0.366191649964E+03 0.46897E-04 -0.24674E-04 30678 0.622E-02 0.293E-02
DAV: 5 -0.366191647695E+03 0.22692E-05 -0.53537E-05 31164 0.260E-02
17 F= -.36619165E+03 E0= -.36619551E+03 d E =-.113064E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366289336890E+03 -0.97687E-01 -0.21027E+01 25536 0.153E+01 0.128E+00
DAV: 2 -0.366310230853E+03 -0.20894E-01 -0.48422E-01 28092 0.214E+00 0.745E-01
DAV: 3 -0.366302981664E+03 0.72492E-02 -0.37856E-02 33156 0.697E-01 0.358E-01
DAV: 4 -0.366301731978E+03 0.12497E-02 -0.68856E-03 32604 0.344E-01 0.152E-01
DAV: 5 -0.366301682819E+03 0.49159E-04 -0.15809E-03 31008 0.143E-01 0.552E-02
DAV: 6 -0.366301713468E+03 -0.30649E-04 -0.28123E-04 29748 0.619E-02 0.329E-02
DAV: 7 -0.366301760809E+03 -0.47341E-04 -0.57106E-05 29448 0.299E-02 0.147E-02
DAV: 8 -0.366301805292E+03 -0.44483E-04 -0.20408E-05 23604 0.177E-02 0.597E-03
DAV: 9 -0.366301857176E+03 -0.51884E-04 -0.71788E-06 20430 0.114E-02 0.347E-03
DAV: 10 -0.366301908738E+03 -0.51562E-04 -0.51432E-06 20664 0.949E-03 0.243E-03
DAV: 11 -0.366301953161E+03 -0.44423E-04 -0.47431E-06 20466 0.777E-03 0.156E-03
DAV: 12 -0.366301974438E+03 -0.21278E-04 -0.23465E-06 20904 0.420E-03 0.887E-04
DAV: 13 -0.366301983804E+03 -0.93658E-05 -0.98318E-07 20832 0.229E-03
18 F= -.36630198E+03 E0= -.36630585E+03 d E =-.110336E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366308410065E+03 -0.64356E-02 -0.25485E+00 25536 0.535E+00 0.448E-01
DAV: 2 -0.366310838099E+03 -0.24280E-02 -0.59104E-02 27450 0.749E-01 0.258E-01
DAV: 3 -0.366309990372E+03 0.84773E-03 -0.44933E-03 32856 0.241E-01 0.126E-01
DAV: 4 -0.366309848818E+03 0.14155E-03 -0.86237E-04 32640 0.122E-01 0.522E-02
DAV: 5 -0.366309845267E+03 0.35514E-05 -0.18612E-04 30564 0.495E-02 0.194E-02
DAV: 6 -0.366309853267E+03 -0.80005E-05 -0.35835E-05 28674 0.217E-02
19 F= -.36630985E+03 E0= -.36631372E+03 d E =-.118206E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366377664010E+03 -0.67819E-01 -0.93384E+00 25536 0.102E+01 0.807E-01
DAV: 2 -0.366390627035E+03 -0.12963E-01 -0.22486E-01 28194 0.143E+00 0.493E-01
DAV: 3 -0.366387490377E+03 0.31367E-02 -0.12595E-02 33156 0.401E-01 0.249E-01
DAV: 4 -0.366386797039E+03 0.69334E-03 -0.28741E-03 30354 0.220E-01 0.832E-02
DAV: 5 -0.366386804363E+03 -0.73235E-05 -0.63310E-04 31320 0.887E-02 0.369E-02
DAV: 6 -0.366386828132E+03 -0.23769E-04 -0.87919E-05 29712 0.351E-02 0.212E-02
DAV: 7 -0.366386872146E+03 -0.44014E-04 -0.20549E-05 21720 0.192E-02 0.817E-03
DAV: 8 -0.366386921513E+03 -0.49367E-04 -0.12030E-05 20544 0.133E-02 0.423E-03
DAV: 9 -0.366386971708E+03 -0.50195E-04 -0.47008E-06 20364 0.898E-03 0.271E-03
DAV: 10 -0.366387027104E+03 -0.55396E-04 -0.54668E-06 20832 0.773E-03 0.176E-03
DAV: 11 -0.366387062348E+03 -0.35243E-04 -0.34441E-06 20688 0.496E-03 0.108E-03
DAV: 12 -0.366387079779E+03 -0.17431E-04 -0.17323E-06 20916 0.283E-03 0.640E-04
DAV: 13 -0.366387089609E+03 -0.98307E-05 -0.11323E-06 20526 0.203E-03
20 F= -.36638709E+03 E0= -.36639095E+03 d E =-.772363E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366401948626E+03 -0.14869E-01 -0.71683E+00 25536 0.890E+00 0.707E-01
DAV: 2 -0.366411890634E+03 -0.99420E-02 -0.17250E-01 28194 0.125E+00 0.431E-01
DAV: 3 -0.366409515690E+03 0.23749E-02 -0.95795E-03 32562 0.349E-01 0.218E-01
DAV: 4 -0.366408989388E+03 0.52630E-03 -0.21902E-03 30660 0.191E-01 0.729E-02
DAV: 5 -0.366408985562E+03 0.38266E-05 -0.47047E-04 31662 0.766E-02 0.322E-02
DAV: 6 -0.366408996603E+03 -0.11042E-04 -0.66772E-05 29424 0.305E-02 0.185E-02
DAV: 7 -0.366409022556E+03 -0.25953E-04 -0.15303E-05 20124 0.165E-02 0.718E-03
DAV: 8 -0.366409054580E+03 -0.32023E-04 -0.91445E-06 20232 0.116E-02 0.356E-03
DAV: 9 -0.366409084898E+03 -0.30318E-04 -0.30863E-06 20220 0.708E-03 0.233E-03
DAV: 10 -0.366409123574E+03 -0.38676E-04 -0.35556E-06 20058 0.655E-03 0.143E-03
DAV: 11 -0.366409147299E+03 -0.23725E-04 -0.25771E-06 20946 0.428E-03 0.999E-04
DAV: 12 -0.366409160165E+03 -0.12866E-04 -0.13551E-06 21072 0.267E-03 0.628E-04
DAV: 13 -0.366409167541E+03 -0.73762E-05 -0.89697E-07 20796 0.181E-03
21 F= -.36640917E+03 E0= -.36641303E+03 d E =-.993143E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366472087174E+03 -0.62927E-01 -0.51345E+00 25536 0.748E+00 0.660E-01
DAV: 2 -0.366475662024E+03 -0.35748E-02 -0.11081E-01 28170 0.102E+00 0.398E-01
DAV: 3 -0.366473396519E+03 0.22655E-02 -0.79686E-03 31254 0.307E-01 0.192E-01
DAV: 4 -0.366472975406E+03 0.42111E-03 -0.17307E-03 32592 0.152E-01 0.647E-02
DAV: 5 -0.366472962013E+03 0.13393E-04 -0.30294E-04 31032 0.618E-02 0.247E-02
DAV: 6 -0.366472982080E+03 -0.20067E-04 -0.31877E-05 28206 0.198E-02 0.130E-02
DAV: 7 -0.366473017104E+03 -0.35025E-04 -0.97021E-06 19842 0.117E-02 0.443E-03
DAV: 8 -0.366473050836E+03 -0.33732E-04 -0.36414E-06 20232 0.593E-03 0.277E-03
DAV: 9 -0.366473098150E+03 -0.47314E-04 -0.36731E-06 19860 0.514E-03 0.166E-03
DAV: 10 -0.366473129444E+03 -0.31294E-04 -0.26989E-06 20586 0.354E-03 0.117E-03
DAV: 11 -0.366473148067E+03 -0.18623E-04 -0.17613E-06 20466 0.306E-03 0.762E-04
DAV: 12 -0.366473157048E+03 -0.89803E-05 -0.10059E-06 20706 0.205E-03
22 F= -.36647316E+03 E0= -.36647702E+03 d E =-.639895E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366505709613E+03 -0.32562E-01 -0.11747E+01 25536 0.113E+01 0.998E-01
DAV: 2 -0.366514199938E+03 -0.84903E-02 -0.25508E-01 28104 0.154E+00 0.606E-01
DAV: 3 -0.366508927289E+03 0.52726E-02 -0.18568E-02 31440 0.468E-01 0.292E-01
DAV: 4 -0.366507927815E+03 0.99947E-03 -0.39486E-03 32550 0.230E-01 0.986E-02
DAV: 5 -0.366507900603E+03 0.27212E-04 -0.71779E-04 30504 0.942E-02 0.377E-02
DAV: 6 -0.366507940689E+03 -0.40086E-04 -0.72408E-05 29370 0.300E-02 0.199E-02
DAV: 7 -0.366508011963E+03 -0.71275E-04 -0.21969E-05 20994 0.173E-02 0.683E-03
DAV: 8 -0.366508079467E+03 -0.67504E-04 -0.70680E-06 20418 0.879E-03 0.417E-03
DAV: 9 -0.366508169348E+03 -0.89881E-04 -0.83194E-06 21204 0.738E-03 0.267E-03
DAV: 10 -0.366508232444E+03 -0.63096E-04 -0.47312E-06 20580 0.531E-03 0.163E-03
DAV: 11 -0.366508268900E+03 -0.36455E-04 -0.39335E-06 21210 0.415E-03 0.123E-03
DAV: 12 -0.366508286412E+03 -0.17513E-04 -0.14062E-06 20790 0.285E-03 0.715E-04
DAV: 13 -0.366508297639E+03 -0.11227E-04 -0.13185E-06 20106 0.239E-03 0.504E-04
DAV: 14 -0.366508300739E+03 -0.31002E-05 -0.45229E-07 21360 0.149E-03
23 F= -.36650830E+03 E0= -.36651217E+03 d E =-.991332E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366556696434E+03 -0.48399E-01 -0.36410E+00 25536 0.631E+00 0.560E-01
DAV: 2 -0.366559034102E+03 -0.23377E-02 -0.78427E-02 26832 0.861E-01 0.355E-01
DAV: 3 -0.366557188136E+03 0.18460E-02 -0.65542E-03 32112 0.300E-01 0.164E-01
DAV: 4 -0.366556869307E+03 0.31883E-03 -0.14359E-03 32964 0.146E-01 0.560E-02
DAV: 5 -0.366556870376E+03 -0.10684E-05 -0.27197E-04 31188 0.570E-02 0.263E-02
DAV: 6 -0.366556879855E+03 -0.94789E-05 -0.27493E-05 23952 0.194E-02
24 F= -.36655688E+03 E0= -.36656075E+03 d E =-.485791E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366593076253E+03 -0.36206E-01 -0.21747E+01 25536 0.154E+01 0.137E+00
DAV: 2 -0.366607624097E+03 -0.14548E-01 -0.46620E-01 26772 0.210E+00 0.869E-01
DAV: 3 -0.366596409836E+03 0.11214E-01 -0.38793E-02 31656 0.730E-01 0.402E-01
DAV: 4 -0.366594453015E+03 0.19568E-02 -0.84091E-03 32364 0.354E-01 0.137E-01
DAV: 5 -0.366594463545E+03 -0.10530E-04 -0.16257E-03 30192 0.139E-01 0.636E-02
DAV: 6 -0.366594520171E+03 -0.56625E-04 -0.17590E-04 29316 0.473E-02 0.307E-02
DAV: 7 -0.366594626108E+03 -0.10594E-03 -0.48336E-05 29400 0.306E-02 0.113E-02
DAV: 8 -0.366594734942E+03 -0.10883E-03 -0.13051E-05 21840 0.154E-02 0.645E-03
DAV: 9 -0.366594859344E+03 -0.12440E-03 -0.15481E-05 21336 0.159E-02 0.441E-03
DAV: 10 -0.366594958169E+03 -0.98825E-04 -0.10655E-05 22002 0.129E-02 0.299E-03
DAV: 11 -0.366595005476E+03 -0.47307E-04 -0.36438E-06 21528 0.607E-03 0.203E-03
DAV: 12 -0.366595041299E+03 -0.35823E-04 -0.23895E-06 20520 0.369E-03 0.962E-04
DAV: 13 -0.366595058844E+03 -0.17546E-04 -0.10546E-06 20946 0.242E-03 0.672E-04
DAV: 14 -0.366595069432E+03 -0.10588E-04 -0.61920E-07 20016 0.165E-03 0.403E-04
DAV: 15 -0.366595074960E+03 -0.55277E-05 -0.38571E-07 20010 0.138E-03
25 F= -.36659507E+03 E0= -.36659894E+03 d E =-.867742E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366645644469E+03 -0.50575E-01 -0.72163E+00 25536 0.884E+00 0.812E-01
DAV: 2 -0.366648920089E+03 -0.32756E-02 -0.15166E-01 26676 0.121E+00 0.472E-01
DAV: 3 -0.366645656416E+03 0.32637E-02 -0.10892E-02 30834 0.361E-01 0.215E-01
DAV: 4 -0.366645153001E+03 0.50342E-03 -0.24463E-03 31452 0.178E-01 0.696E-02
DAV: 5 -0.366645139353E+03 0.13647E-04 -0.35046E-04 30960 0.655E-02 0.310E-02
DAV: 6 -0.366645156983E+03 -0.17630E-04 -0.47275E-05 29310 0.248E-02 0.158E-02
DAV: 7 -0.366645187095E+03 -0.30112E-04 -0.10242E-05 19974 0.132E-02 0.575E-03
DAV: 8 -0.366645220739E+03 -0.33644E-04 -0.49498E-06 20100 0.799E-03 0.322E-03
DAV: 9 -0.366645254994E+03 -0.34255E-04 -0.25068E-06 20148 0.558E-03 0.199E-03
DAV: 10 -0.366645292092E+03 -0.37098E-04 -0.27714E-06 20058 0.471E-03 0.132E-03
DAV: 11 -0.366645314016E+03 -0.21924E-04 -0.16962E-06 20352 0.305E-03 0.815E-04
DAV: 12 -0.366645327029E+03 -0.13013E-04 -0.10279E-06 20100 0.202E-03 0.548E-04
DAV: 13 -0.366645333160E+03 -0.61316E-05 -0.54508E-07 20202 0.160E-03
26 F= -.36664533E+03 E0= -.36664920E+03 d E =-.502582E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366670946479E+03 -0.25619E-01 -0.13361E+01 25536 0.120E+01 0.110E+00
DAV: 2 -0.366677386669E+03 -0.64402E-02 -0.28013E-01 26508 0.165E+00 0.641E-01
DAV: 3 -0.366671367651E+03 0.60190E-02 -0.20255E-02 30960 0.492E-01 0.292E-01
DAV: 4 -0.366670450997E+03 0.91665E-03 -0.44984E-03 31488 0.241E-01 0.946E-02
DAV: 5 -0.366670424501E+03 0.26495E-04 -0.64751E-04 30804 0.892E-02 0.421E-02
DAV: 6 -0.366670452500E+03 -0.27999E-04 -0.88445E-05 29682 0.337E-02 0.216E-02
DAV: 7 -0.366670502275E+03 -0.49774E-04 -0.20737E-05 25284 0.179E-02 0.790E-03
DAV: 8 -0.366670554862E+03 -0.52587E-04 -0.66776E-06 20148 0.984E-03 0.415E-03
DAV: 9 -0.366670611295E+03 -0.56433E-04 -0.44310E-06 20106 0.706E-03 0.279E-03
DAV: 10 -0.366670677373E+03 -0.66078E-04 -0.50901E-06 20028 0.643E-03 0.163E-03
DAV: 11 -0.366670713248E+03 -0.35875E-04 -0.30420E-06 20460 0.392E-03 0.111E-03
DAV: 12 -0.366670733610E+03 -0.20362E-04 -0.16038E-06 20298 0.249E-03 0.594E-04
DAV: 13 -0.366670743526E+03 -0.99157E-05 -0.93242E-07 20250 0.187E-03
27 F= -.36667074E+03 E0= -.36667461E+03 d E =-.756686E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366728313033E+03 -0.57579E-01 -0.63884E+00 25536 0.827E+00 0.854E-01
DAV: 2 -0.366730352035E+03 -0.20390E-02 -0.15678E-01 27168 0.121E+00 0.445E-01
DAV: 3 -0.366727173092E+03 0.31789E-02 -0.12599E-02 31344 0.376E-01 0.201E-01
DAV: 4 -0.366726722899E+03 0.45019E-03 -0.22852E-03 32316 0.179E-01 0.793E-02
DAV: 5 -0.366726699247E+03 0.23652E-04 -0.39411E-04 30972 0.719E-02 0.310E-02
DAV: 6 -0.366726723006E+03 -0.23759E-04 -0.61687E-05 29856 0.272E-02 0.153E-02
DAV: 7 -0.366726753635E+03 -0.30629E-04 -0.11763E-05 20586 0.141E-02 0.604E-03
DAV: 8 -0.366726790541E+03 -0.36906E-04 -0.62844E-06 20238 0.913E-03 0.327E-03
DAV: 9 -0.366726822079E+03 -0.31538E-04 -0.25177E-06 20562 0.623E-03 0.187E-03
DAV: 10 -0.366726856707E+03 -0.34628E-04 -0.35853E-06 20040 0.644E-03 0.172E-03
DAV: 11 -0.366726872833E+03 -0.16126E-04 -0.17447E-06 21060 0.412E-03 0.917E-04
DAV: 12 -0.366726882516E+03 -0.96834E-05 -0.10771E-06 20298 0.267E-03
28 F= -.36672688E+03 E0= -.36673075E+03 d E =-.561390E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366736396971E+03 -0.95241E-02 -0.21809E+00 25536 0.484E+00 0.499E-01
DAV: 2 -0.366737141352E+03 -0.74438E-03 -0.54328E-02 26772 0.710E-01 0.260E-01
DAV: 3 -0.366736053164E+03 0.10882E-02 -0.42940E-03 30912 0.220E-01 0.118E-01
DAV: 4 -0.366735894934E+03 0.15823E-03 -0.79041E-04 32760 0.105E-01 0.466E-02
DAV: 5 -0.366735887576E+03 0.73586E-05 -0.13750E-04 30768 0.423E-02 0.183E-02
DAV: 6 -0.366735897435E+03 -0.98592E-05 -0.19004E-05 20814 0.160E-02
29 F= -.36673590E+03 E0= -.36673976E+03 d E =-.651539E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366781585766E+03 -0.45698E-01 -0.64651E+00 25536 0.834E+00 0.786E-01
DAV: 2 -0.366785448310E+03 -0.38625E-02 -0.14882E-01 28296 0.118E+00 0.427E-01
DAV: 3 -0.366783076098E+03 0.23722E-02 -0.10706E-02 30858 0.371E-01 0.206E-01
DAV: 4 -0.366782712515E+03 0.36358E-03 -0.25925E-03 31512 0.195E-01 0.839E-02
DAV: 5 -0.366782712487E+03 0.27894E-07 -0.42854E-04 30120 0.737E-02 0.355E-02
DAV: 6 -0.366782738871E+03 -0.26385E-04 -0.91678E-05 29436 0.336E-02 0.181E-02
DAV: 7 -0.366782768832E+03 -0.29960E-04 -0.12868E-05 20220 0.163E-02 0.684E-03
DAV: 8 -0.366782801567E+03 -0.32736E-04 -0.99258E-06 20568 0.110E-02 0.393E-03
DAV: 9 -0.366782826810E+03 -0.25243E-04 -0.22508E-06 20736 0.632E-03 0.221E-03
DAV: 10 -0.366782866043E+03 -0.39232E-04 -0.37228E-06 20106 0.664E-03 0.203E-03
DAV: 11 -0.366782890655E+03 -0.24612E-04 -0.20364E-06 20328 0.492E-03 0.108E-03
DAV: 12 -0.366782904881E+03 -0.14226E-04 -0.13147E-06 20394 0.312E-03 0.108E-03
DAV: 13 -0.366782911453E+03 -0.65718E-05 -0.56270E-07 20478 0.205E-03
30 F= -.36678291E+03 E0= -.36678678E+03 d E =-.470140E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366794014209E+03 -0.11109E-01 -0.40678E+00 25536 0.661E+00 0.623E-01
DAV: 2 -0.366796358725E+03 -0.23445E-02 -0.92456E-02 27150 0.936E-01 0.335E-01
DAV: 3 -0.366794904697E+03 0.14540E-02 -0.66739E-03 30792 0.292E-01 0.162E-01
DAV: 4 -0.366794674691E+03 0.23001E-03 -0.15887E-03 31872 0.153E-01 0.658E-02
DAV: 5 -0.366794666183E+03 0.85087E-05 -0.25265E-04 30864 0.569E-02 0.278E-02
DAV: 6 -0.366794676988E+03 -0.10806E-04 -0.56776E-05 28692 0.264E-02 0.140E-02
DAV: 7 -0.366794690424E+03 -0.13435E-04 -0.80700E-06 20082 0.132E-02 0.534E-03
DAV: 8 -0.366794707153E+03 -0.16730E-04 -0.60577E-06 20148 0.868E-03 0.301E-03
DAV: 9 -0.366794720270E+03 -0.13116E-04 -0.12992E-06 20544 0.474E-03 0.170E-03
DAV: 10 -0.366794742535E+03 -0.22265E-04 -0.20833E-06 19950 0.511E-03 0.150E-03
DAV: 11 -0.366794757044E+03 -0.14509E-04 -0.11579E-06 20268 0.389E-03 0.801E-04
DAV: 12 -0.366794765680E+03 -0.86363E-05 -0.75662E-07 20370 0.237E-03
31 F= -.36679477E+03 E0= -.36679863E+03 d E =-.588682E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366831331501E+03 -0.36574E-01 -0.10037E+01 25536 0.103E+01 0.883E-01
DAV: 2 -0.366842852718E+03 -0.11521E-01 -0.22999E-01 27972 0.142E+00 0.461E-01
DAV: 3 -0.366840435606E+03 0.24171E-02 -0.91653E-03 31800 0.338E-01 0.246E-01
DAV: 4 -0.366839881607E+03 0.55400E-03 -0.36438E-03 31200 0.227E-01 0.748E-02
DAV: 5 -0.366839882765E+03 -0.11586E-05 -0.62585E-04 30936 0.910E-02 0.396E-02
DAV: 6 -0.366839893845E+03 -0.11080E-04 -0.15568E-04 28956 0.403E-02 0.213E-02
DAV: 7 -0.366839908278E+03 -0.14432E-04 -0.22907E-05 25698 0.206E-02 0.836E-03
DAV: 8 -0.366839931400E+03 -0.23123E-04 -0.94712E-06 19956 0.130E-02 0.457E-03
DAV: 9 -0.366839952339E+03 -0.20939E-04 -0.28163E-06 20478 0.871E-03 0.252E-03
DAV: 10 -0.366839988367E+03 -0.36028E-04 -0.62105E-06 19932 0.122E-02 0.365E-03
DAV: 11 -0.366840004203E+03 -0.15836E-04 -0.35385E-06 21684 0.752E-03 0.157E-03
DAV: 12 -0.366840014505E+03 -0.10302E-04 -0.24609E-06 21024 0.518E-03 0.187E-03
DAV: 13 -0.366840019626E+03 -0.51202E-05 -0.69708E-07 21168 0.306E-03
32 F= -.36684002E+03 E0= -.36684389E+03 d E =-.452539E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366843354605E+03 -0.33401E-02 -0.24309E+00 25536 0.506E+00 0.436E-01
DAV: 2 -0.366846123805E+03 -0.27692E-02 -0.56168E-02 27456 0.702E-01 0.226E-01
DAV: 3 -0.366845555491E+03 0.56831E-03 -0.21845E-03 31116 0.166E-01 0.121E-01
DAV: 4 -0.366845426932E+03 0.12856E-03 -0.92396E-04 31146 0.114E-01 0.369E-02
DAV: 5 -0.366845427928E+03 -0.99613E-06 -0.15805E-04 31056 0.457E-02 0.199E-02
DAV: 6 -0.366845431698E+03 -0.37698E-05 -0.40548E-05 28230 0.204E-02
33 F= -.36684543E+03 E0= -.36684930E+03 d E =-.506660E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366864267877E+03 -0.18840E-01 -0.11809E+01 25536 0.112E+01 0.878E-01
DAV: 2 -0.366883300592E+03 -0.19033E-01 -0.28317E-01 28488 0.154E+00 0.471E-01
DAV: 3 -0.366881023575E+03 0.22770E-02 -0.94497E-03 32088 0.344E-01 0.258E-01
DAV: 4 -0.366880661819E+03 0.36176E-03 -0.38292E-03 30564 0.227E-01 0.746E-02
DAV: 5 -0.366880692690E+03 -0.30871E-04 -0.65982E-04 29508 0.920E-02 0.378E-02
DAV: 6 -0.366880717524E+03 -0.24834E-04 -0.13267E-04 29544 0.357E-02 0.199E-02
DAV: 7 -0.366880735943E+03 -0.18419E-04 -0.22667E-05 24480 0.199E-02 0.852E-03
DAV: 8 -0.366880760883E+03 -0.24940E-04 -0.63714E-06 20502 0.899E-03 0.374E-03
DAV: 9 -0.366880783755E+03 -0.22872E-04 -0.18459E-06 20688 0.574E-03 0.168E-03
DAV: 10 -0.366880812741E+03 -0.28987E-04 -0.31284E-06 20208 0.666E-03 0.254E-03
DAV: 11 -0.366880828244E+03 -0.15503E-04 -0.17389E-06 20904 0.514E-03 0.842E-04
DAV: 12 -0.366880836003E+03 -0.77591E-05 -0.10434E-06 20874 0.304E-03
34 F= -.36688084E+03 E0= -.36688470E+03 d E =-.354043E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366881196952E+03 -0.36871E-03 -0.49096E-01 25560 0.227E+00 0.180E-01
DAV: 2 -0.366881978793E+03 -0.78184E-03 -0.11963E-02 28452 0.316E-01 0.963E-02
DAV: 3 -0.366881890114E+03 0.88679E-04 -0.39065E-04 31080 0.709E-02 0.535E-02
DAV: 4 -0.366881885002E+03 0.51122E-05 -0.17050E-04 29730 0.477E-02 0.157E-02
DAV: 5 -0.366881886486E+03 -0.14842E-05 -0.28681E-05 25776 0.197E-02
35 F= -.36688189E+03 E0= -.36688575E+03 d E =-.364548E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366891277952E+03 -0.93929E-02 -0.58287E+00 25536 0.785E+00 0.551E-01
DAV: 2 -0.366902840761E+03 -0.11563E-01 -0.14143E-01 28362 0.108E+00 0.344E-01
DAV: 3 -0.366901780682E+03 0.10601E-02 -0.42145E-03 31836 0.236E-01 0.199E-01
DAV: 4 -0.366901497872E+03 0.28281E-03 -0.18972E-03 29202 0.158E-01 0.511E-02
DAV: 5 -0.366901505720E+03 -0.78481E-05 -0.34119E-04 31908 0.630E-02 0.291E-02
DAV: 6 -0.366901512742E+03 -0.70224E-05 -0.65636E-05 29430 0.267E-02
36 F= -.36690151E+03 E0= -.36690538E+03 d E =-.196263E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366901531594E+03 -0.25874E-04 -0.57318E-03 26910 0.247E-01 0.199E-02
DAV: 2 -0.366901555052E+03 -0.23458E-04 -0.15570E-04 30294 0.357E-02 0.119E-02
DAV: 3 -0.366901565283E+03 -0.10231E-04 -0.49549E-06 20304 0.888E-03 0.652E-03
DAV: 4 -0.366901583724E+03 -0.18441E-04 -0.37751E-06 20082 0.696E-03 0.220E-03
DAV: 5 -0.366901597384E+03 -0.13661E-04 -0.14203E-06 20688 0.412E-03 0.155E-03
DAV: 6 -0.366901615797E+03 -0.18412E-04 -0.15388E-06 19806 0.377E-03 0.841E-04
DAV: 7 -0.366901624663E+03 -0.88666E-05 -0.89652E-07 21432 0.237E-03
37 F= -.36690162E+03 E0= -.36690549E+03 d E =-.197382E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366911898349E+03 -0.10283E-01 -0.37981E+00 25536 0.624E+00 0.456E-01
DAV: 2 -0.366918450073E+03 -0.65517E-02 -0.86072E-02 29304 0.840E-01 0.257E-01
DAV: 3 -0.366917872533E+03 0.57754E-03 -0.27101E-03 32088 0.177E-01 0.147E-01
DAV: 4 -0.366917785905E+03 0.86628E-04 -0.94012E-04 29220 0.114E-01 0.400E-02
DAV: 5 -0.366917804060E+03 -0.18155E-04 -0.19473E-04 31272 0.462E-02 0.204E-02
DAV: 6 -0.366917805176E+03 -0.11153E-05 -0.21384E-05 24396 0.159E-02
38 F= -.36691781E+03 E0= -.36692167E+03 d E =-.161805E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366918223838E+03 -0.41978E-03 -0.31234E-01 25536 0.179E+00 0.133E-01
DAV: 2 -0.366918765944E+03 -0.54211E-03 -0.71955E-03 28734 0.242E-01 0.737E-02
DAV: 3 -0.366918721422E+03 0.44522E-04 -0.22109E-04 32088 0.511E-02 0.423E-02
DAV: 4 -0.366918721172E+03 0.24931E-06 -0.78981E-05 27774 0.337E-02
39 F= -.36691872E+03 E0= -.36692259E+03 d E =-.170965E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366928097278E+03 -0.93759E-02 -0.30146E+00 25536 0.567E+00 0.408E-01
DAV: 2 -0.366932961639E+03 -0.48644E-02 -0.66021E-02 27870 0.752E-01 0.244E-01
DAV: 3 -0.366932495955E+03 0.46568E-03 -0.25252E-03 33192 0.176E-01 0.133E-01
DAV: 4 -0.366932425338E+03 0.70617E-04 -0.62254E-04 31038 0.959E-02 0.378E-02
DAV: 5 -0.366932440846E+03 -0.15508E-04 -0.12731E-04 32160 0.391E-02 0.167E-02
DAV: 6 -0.366932447990E+03 -0.71434E-05 -0.22443E-05 26124 0.162E-02
40 F= -.36693245E+03 E0= -.36693631E+03 d E =-.137268E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366932834904E+03 -0.39406E-03 -0.25725E-01 25536 0.166E+00 0.119E-01
DAV: 2 -0.366933249273E+03 -0.41437E-03 -0.57039E-03 26772 0.221E-01 0.711E-02
DAV: 3 -0.366933215484E+03 0.33789E-04 -0.21685E-04 33360 0.519E-02 0.387E-02
DAV: 4 -0.366933219084E+03 -0.36001E-05 -0.52702E-05 28080 0.281E-02
41 F= -.36693322E+03 E0= -.36693708E+03 d E =-.144979E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366942168499E+03 -0.89530E-02 -0.20207E+00 25536 0.466E+00 0.336E-01
DAV: 2 -0.366945361751E+03 -0.31933E-02 -0.44664E-02 27630 0.628E-01 0.200E-01
DAV: 3 -0.366945072080E+03 0.28967E-03 -0.17241E-03 31530 0.147E-01 0.109E-01
DAV: 4 -0.366945049068E+03 0.23012E-04 -0.47071E-04 31794 0.852E-02 0.332E-02
DAV: 5 -0.366945060836E+03 -0.11768E-04 -0.86987E-05 31290 0.326E-02 0.143E-02
DAV: 6 -0.366945064415E+03 -0.35787E-05 -0.14026E-05 22260 0.131E-02
42 F= -.36694506E+03 E0= -.36694893E+03 d E =-.118453E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366946387739E+03 -0.13269E-02 -0.90204E-01 25536 0.312E+00 0.224E-01
DAV: 2 -0.366947808269E+03 -0.14205E-02 -0.20030E-02 27846 0.420E-01 0.133E-01
DAV: 3 -0.366947676983E+03 0.13129E-03 -0.76563E-04 31560 0.984E-02 0.728E-02
DAV: 4 -0.366947667124E+03 0.98591E-05 -0.21033E-04 32184 0.573E-02 0.221E-02
DAV: 5 -0.366947674569E+03 -0.74453E-05 -0.39053E-05 29112 0.218E-02
43 F= -.36694767E+03 E0= -.36695154E+03 d E =-.144555E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366956562156E+03 -0.88950E-02 -0.13606E+00 25536 0.382E+00 0.282E-01
DAV: 2 -0.366958411542E+03 -0.18494E-02 -0.28301E-02 27900 0.501E-01 0.174E-01
DAV: 3 -0.366958126312E+03 0.28523E-03 -0.10530E-03 31380 0.123E-01 0.925E-02
DAV: 4 -0.366958085131E+03 0.41181E-04 -0.44784E-04 30042 0.785E-02 0.247E-02
DAV: 5 -0.366958089043E+03 -0.39116E-05 -0.86901E-05 31224 0.356E-02
44 F= -.36695809E+03 E0= -.36696195E+03 d E =-.104145E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366959853228E+03 -0.17681E-02 -0.11955E+00 25536 0.358E+00 0.265E-01
DAV: 2 -0.366961481967E+03 -0.16287E-02 -0.25005E-02 28062 0.470E-01 0.163E-01
DAV: 3 -0.366961227191E+03 0.25478E-03 -0.92580E-04 31680 0.116E-01 0.873E-02
DAV: 4 -0.366961185946E+03 0.41245E-04 -0.39842E-04 29718 0.743E-02 0.234E-02
DAV: 5 -0.366961191507E+03 -0.55610E-05 -0.79433E-05 31692 0.342E-02
45 F= -.36696119E+03 E0= -.36696506E+03 d E =-.135169E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366968219276E+03 -0.70333E-02 -0.95860E-01 25536 0.321E+00 0.245E-01
DAV: 2 -0.366969421026E+03 -0.12018E-02 -0.19617E-02 27744 0.420E-01 0.157E-01
DAV: 3 -0.366969179442E+03 0.24158E-03 -0.94220E-04 31320 0.118E-01 0.779E-02
DAV: 4 -0.366969160300E+03 0.19142E-04 -0.30125E-04 29130 0.662E-02 0.234E-02
DAV: 5 -0.366969168752E+03 -0.84519E-05 -0.53594E-05 29922 0.282E-02
46 F= -.36696917E+03 E0= -.36697303E+03 d E =-.797725E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366971574195E+03 -0.24139E-02 -0.21067E+00 25536 0.476E+00 0.363E-01
DAV: 2 -0.366974229485E+03 -0.26553E-02 -0.43020E-02 26958 0.622E-01 0.233E-01
DAV: 3 -0.366973683746E+03 0.54574E-03 -0.20570E-03 31752 0.174E-01 0.115E-01
DAV: 4 -0.366973625273E+03 0.58473E-04 -0.65408E-04 29196 0.977E-02 0.344E-02
DAV: 5 -0.366973637113E+03 -0.11841E-04 -0.11661E-04 30708 0.413E-02 0.174E-02
DAV: 6 -0.366973655670E+03 -0.18557E-04 -0.23645E-05 25638 0.157E-02 0.928E-03
DAV: 7 -0.366973675347E+03 -0.19677E-04 -0.47655E-06 20466 0.937E-03 0.357E-03
DAV: 8 -0.366973697902E+03 -0.22555E-04 -0.29684E-06 20532 0.553E-03 0.194E-03
DAV: 9 -0.366973711719E+03 -0.13816E-04 -0.91428E-07 21588 0.321E-03 0.112E-03
DAV: 10 -0.366973734510E+03 -0.22791E-04 -0.20781E-06 19902 0.405E-03 0.102E-03
DAV: 11 -0.366973740988E+03 -0.64777E-05 -0.75108E-07 22128 0.226E-03
47 F= -.36697374E+03 E0= -.36697761E+03 d E =-.125495E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366982126153E+03 -0.83916E-02 -0.15020E+00 25536 0.402E+00 0.304E-01
DAV: 2 -0.366984052406E+03 -0.19263E-02 -0.30823E-02 28926 0.534E-01 0.186E-01
DAV: 3 -0.366983768164E+03 0.28424E-03 -0.12989E-03 30108 0.129E-01 0.981E-02
DAV: 4 -0.366983730199E+03 0.37965E-04 -0.39103E-04 30600 0.716E-02 0.272E-02
DAV: 5 -0.366983731648E+03 -0.14486E-05 -0.63583E-05 31476 0.300E-02
48 F= -.36698373E+03 E0= -.36698760E+03 d E =-.999066E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366985704103E+03 -0.19739E-02 -0.26628E+00 25536 0.535E+00 0.405E-01
DAV: 2 -0.366989167033E+03 -0.34629E-02 -0.54744E-02 29418 0.711E-01 0.247E-01
DAV: 3 -0.366988647091E+03 0.51994E-03 -0.22903E-03 31092 0.172E-01 0.131E-01
DAV: 4 -0.366988576150E+03 0.70941E-04 -0.69093E-04 30378 0.954E-02 0.361E-02
DAV: 5 -0.366988587449E+03 -0.11300E-04 -0.11307E-04 30390 0.398E-02 0.157E-02
DAV: 6 -0.366988603466E+03 -0.16017E-04 -0.16966E-05 23916 0.139E-02 0.867E-03
DAV: 7 -0.366988626611E+03 -0.23145E-04 -0.41648E-06 19992 0.822E-03 0.329E-03
DAV: 8 -0.366988650930E+03 -0.24319E-04 -0.26322E-06 20760 0.533E-03 0.173E-03
DAV: 9 -0.366988668717E+03 -0.17786E-04 -0.12328E-06 21180 0.318E-03 0.112E-03
DAV: 10 -0.366988692912E+03 -0.24195E-04 -0.24111E-06 19974 0.367E-03 0.733E-04
DAV: 11 -0.366988699267E+03 -0.63546E-05 -0.88061E-07 22152 0.212E-03
49 F= -.36698870E+03 E0= -.36699256E+03 d E =-.149583E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366996452365E+03 -0.77595E-02 -0.22913E+00 25536 0.495E+00 0.363E-01
DAV: 2 -0.366999304274E+03 -0.28519E-02 -0.44740E-02 29724 0.645E-01 0.230E-01
DAV: 3 -0.366998845067E+03 0.45921E-03 -0.20026E-03 30846 0.164E-01 0.118E-01
DAV: 4 -0.366998781756E+03 0.63311E-04 -0.58419E-04 30366 0.888E-02 0.329E-02
DAV: 5 -0.366998786176E+03 -0.44202E-05 -0.99391E-05 31704 0.363E-02
50 F= -.36699879E+03 E0= -.36700265E+03 d E =-.100869E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.366999432677E+03 -0.65092E-03 -0.15271E+00 25536 0.404E+00 0.297E-01
DAV: 2 -0.367001347677E+03 -0.19150E-02 -0.29998E-02 29538 0.527E-01 0.188E-01
DAV: 3 -0.367001045982E+03 0.30169E-03 -0.13251E-03 31488 0.133E-01 0.969E-02
DAV: 4 -0.367001009200E+03 0.36782E-04 -0.39340E-04 30006 0.730E-02 0.271E-02
DAV: 5 -0.367001022256E+03 -0.13056E-04 -0.67131E-05 29754 0.301E-02 0.126E-02
DAV: 6 -0.367001036739E+03 -0.14483E-04 -0.95007E-06 19884 0.114E-02 0.605E-03
DAV: 7 -0.367001054328E+03 -0.17588E-04 -0.32659E-06 20142 0.629E-03 0.257E-03
DAV: 8 -0.367001073828E+03 -0.19501E-04 -0.17108E-06 20454 0.394E-03 0.124E-03
DAV: 9 -0.367001090433E+03 -0.16604E-04 -0.11085E-06 20742 0.234E-03 0.874E-04
DAV: 10 -0.367001106243E+03 -0.15810E-04 -0.13732E-06 20622 0.219E-03 0.572E-04
DAV: 11 -0.367001113718E+03 -0.74755E-05 -0.78528E-07 21312 0.170E-03
51 F= -.36700111E+03 E0= -.36700498E+03 d E =-.124145E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367008137850E+03 -0.70316E-02 -0.24252E+00 25536 0.509E+00 0.363E-01
DAV: 2 -0.367011425188E+03 -0.32873E-02 -0.46848E-02 28806 0.651E-01 0.235E-01
DAV: 3 -0.367010967797E+03 0.45739E-03 -0.17363E-03 31002 0.158E-01 0.121E-01
DAV: 4 -0.367010903851E+03 0.63947E-04 -0.64119E-04 30048 0.945E-02 0.309E-02
DAV: 5 -0.367010906217E+03 -0.23667E-05 -0.11972E-04 31680 0.394E-02 0.160E-02
DAV: 6 -0.367010909412E+03 -0.31945E-05 -0.16997E-05 22344 0.147E-02
52 F= -.36701091E+03 E0= -.36701478E+03 d E =-.979569E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367011238453E+03 -0.33224E-03 -0.29646E+00 25536 0.562E+00 0.402E-01
DAV: 2 -0.367015267679E+03 -0.40292E-02 -0.57337E-02 29310 0.720E-01 0.260E-01
DAV: 3 -0.367014696143E+03 0.57154E-03 -0.21045E-03 31146 0.175E-01 0.134E-01
DAV: 4 -0.367014617273E+03 0.78871E-04 -0.78378E-04 29670 0.105E-01 0.343E-02
DAV: 5 -0.367014626673E+03 -0.94001E-05 -0.14766E-04 30702 0.439E-02 0.178E-02
DAV: 6 -0.367014637918E+03 -0.11246E-04 -0.21868E-05 24132 0.164E-02 0.907E-03
DAV: 7 -0.367014654881E+03 -0.16962E-04 -0.48224E-06 20082 0.866E-03 0.349E-03
DAV: 8 -0.367014674151E+03 -0.19271E-04 -0.25786E-06 20592 0.558E-03 0.177E-03
DAV: 9 -0.367014691990E+03 -0.17839E-04 -0.14065E-06 20802 0.397E-03 0.965E-04
DAV: 10 -0.367014709894E+03 -0.17904E-04 -0.17108E-06 20478 0.351E-03 0.763E-04
DAV: 11 -0.367014717899E+03 -0.80053E-05 -0.98254E-07 21432 0.237E-03
53 F= -.36701472E+03 E0= -.36701858E+03 d E =-.136042E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367020849748E+03 -0.61399E-02 -0.34624E+00 25536 0.606E+00 0.439E-01
DAV: 2 -0.367025667796E+03 -0.48180E-02 -0.69697E-02 29442 0.790E-01 0.274E-01
DAV: 3 -0.367025026051E+03 0.64175E-03 -0.24349E-03 30558 0.185E-01 0.145E-01
DAV: 4 -0.367024956490E+03 0.69561E-04 -0.98655E-04 30306 0.115E-01 0.383E-02
DAV: 5 -0.367024959625E+03 -0.31349E-05 -0.18535E-04 31344 0.501E-02 0.173E-02
DAV: 6 -0.367024963207E+03 -0.35821E-05 -0.26864E-05 27408 0.171E-02
54 F= -.36702496E+03 E0= -.36702883E+03 d E =-.102453E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367025190309E+03 -0.23068E-03 -0.35656E-01 25536 0.194E+00 0.142E-01
DAV: 2 -0.367025684290E+03 -0.49398E-03 -0.72216E-03 29466 0.254E-01 0.879E-02
DAV: 3 -0.367025621373E+03 0.62917E-04 -0.24904E-04 30738 0.594E-02 0.466E-02
DAV: 4 -0.367025620986E+03 0.38630E-06 -0.10111E-04 28716 0.374E-02 0.122E-02
DAV: 5 -0.367025625955E+03 -0.49684E-05 -0.17988E-05 22668 0.162E-02
55 F= -.36702563E+03 E0= -.36702949E+03 d E =-.109081E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367032273767E+03 -0.66528E-02 -0.27933E+00 25536 0.545E+00 0.387E-01
DAV: 2 -0.367036126832E+03 -0.38531E-02 -0.53851E-02 29058 0.699E-01 0.251E-01
DAV: 3 -0.367035601301E+03 0.52553E-03 -0.19377E-03 30840 0.177E-01 0.134E-01
DAV: 4 -0.367035555400E+03 0.45900E-04 -0.92148E-04 30222 0.108E-01 0.363E-02
DAV: 5 -0.367035553877E+03 0.15234E-05 -0.15940E-04 32844 0.479E-02 0.175E-02
DAV: 6 -0.367035563757E+03 -0.98801E-05 -0.37872E-05 29994 0.196E-02
56 F= -.36703556E+03 E0= -.36703943E+03 d E =-.993780E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367035782195E+03 -0.22832E-03 -0.20611E+00 25536 0.468E+00 0.333E-01
DAV: 2 -0.367038595368E+03 -0.28132E-02 -0.39710E-02 28128 0.601E-01 0.216E-01
DAV: 3 -0.367038208711E+03 0.38666E-03 -0.14318E-03 30912 0.151E-01 0.115E-01
DAV: 4 -0.367038179154E+03 0.29557E-04 -0.66779E-04 30090 0.919E-02 0.309E-02
DAV: 5 -0.367038185441E+03 -0.62876E-05 -0.11402E-04 31422 0.406E-02 0.150E-02
DAV: 6 -0.367038200699E+03 -0.15258E-04 -0.27838E-05 29502 0.169E-02 0.777E-03
DAV: 7 -0.367038215080E+03 -0.14381E-04 -0.42518E-06 20604 0.857E-03 0.333E-03
DAV: 8 -0.367038232988E+03 -0.17907E-04 -0.22005E-06 20628 0.459E-03 0.180E-03
DAV: 9 -0.367038245523E+03 -0.12535E-04 -0.84563E-07 21240 0.307E-03 0.922E-04
DAV: 10 -0.367038265443E+03 -0.19920E-04 -0.21152E-06 20184 0.364E-03 0.173E-03
DAV: 11 -0.367038269789E+03 -0.43461E-05 -0.56602E-07 22008 0.213E-03
57 F= -.36703827E+03 E0= -.36704214E+03 d E =-.126438E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367043781363E+03 -0.55159E-02 -0.24509E+00 25536 0.512E+00 0.368E-01
DAV: 2 -0.367047285775E+03 -0.35044E-02 -0.49799E-02 29892 0.668E-01 0.238E-01
DAV: 3 -0.367046762947E+03 0.52283E-03 -0.16443E-03 32280 0.167E-01 0.130E-01
DAV: 4 -0.367046712342E+03 0.50605E-04 -0.80543E-04 29922 0.104E-01 0.360E-02
DAV: 5 -0.367046713316E+03 -0.97460E-06 -0.13767E-04 33012 0.431E-02 0.169E-02
DAV: 6 -0.367046717229E+03 -0.39127E-05 -0.27345E-05 28530 0.166E-02
58 F= -.36704672E+03 E0= -.36705058E+03 d E =-.844744E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367047003111E+03 -0.28979E-03 -0.13329E+00 25536 0.378E+00 0.272E-01
DAV: 2 -0.367048900867E+03 -0.18978E-02 -0.27141E-02 29298 0.493E-01 0.176E-01
DAV: 3 -0.367048614363E+03 0.28650E-03 -0.90318E-04 32412 0.124E-01 0.955E-02
DAV: 4 -0.367048592811E+03 0.21552E-04 -0.43577E-04 29322 0.773E-02 0.267E-02
DAV: 5 -0.367048599498E+03 -0.66865E-05 -0.75224E-05 30600 0.320E-02
59 F= -.36704860E+03 E0= -.36705247E+03 d E =-.103297E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367054351307E+03 -0.57585E-02 -0.20243E+00 25536 0.465E+00 0.348E-01
DAV: 2 -0.367057144778E+03 -0.27935E-02 -0.42221E-02 27516 0.620E-01 0.217E-01
DAV: 3 -0.367056706845E+03 0.43793E-03 -0.14593E-03 31008 0.147E-01 0.116E-01
DAV: 4 -0.367056655147E+03 0.51698E-04 -0.68054E-04 29568 0.961E-02 0.296E-02
DAV: 5 -0.367056664998E+03 -0.98508E-05 -0.11982E-04 30672 0.407E-02 0.156E-02
DAV: 6 -0.367056678470E+03 -0.13472E-04 -0.23154E-05 27870 0.152E-02 0.822E-03
DAV: 7 -0.367056693601E+03 -0.15131E-04 -0.33864E-06 20520 0.722E-03 0.367E-03
DAV: 8 -0.367056713419E+03 -0.19818E-04 -0.26991E-06 20568 0.519E-03 0.186E-03
DAV: 9 -0.367056729542E+03 -0.16123E-04 -0.12507E-06 21048 0.360E-03 0.897E-04
DAV: 10 -0.367056744496E+03 -0.14954E-04 -0.13927E-06 20814 0.278E-03 0.120E-03
DAV: 11 -0.367056750973E+03 -0.64762E-05 -0.71348E-07 21564 0.233E-03
60 F= -.36705675E+03 E0= -.36706062E+03 d E =-.815148E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367057577624E+03 -0.83313E-03 -0.13070E+00 25536 0.373E+00 0.279E-01
DAV: 2 -0.367059356034E+03 -0.17784E-02 -0.27190E-02 27690 0.498E-01 0.174E-01
DAV: 3 -0.367059075689E+03 0.28035E-03 -0.95478E-04 30294 0.118E-01 0.927E-02
DAV: 4 -0.367059040065E+03 0.35623E-04 -0.43304E-04 29778 0.765E-02 0.236E-02
DAV: 5 -0.367059041118E+03 -0.10522E-05 -0.75399E-05 31536 0.324E-02
61 F= -.36705904E+03 E0= -.36706291E+03 d E =-.104416E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367063660152E+03 -0.46201E-02 -0.21470E+00 25536 0.479E+00 0.367E-01
DAV: 2 -0.367066458624E+03 -0.27985E-02 -0.45689E-02 28842 0.649E-01 0.236E-01
DAV: 3 -0.367065828170E+03 0.63045E-03 -0.21238E-03 31128 0.176E-01 0.120E-01
DAV: 4 -0.367065727752E+03 0.10042E-03 -0.66026E-04 30828 0.979E-02 0.346E-02
DAV: 5 -0.367065745000E+03 -0.17248E-04 -0.12442E-04 31350 0.412E-02 0.167E-02
DAV: 6 -0.367065764479E+03 -0.19479E-04 -0.14383E-05 19674 0.139E-02 0.862E-03
DAV: 7 -0.367065793314E+03 -0.28835E-04 -0.69881E-06 19962 0.845E-03 0.301E-03
DAV: 8 -0.367065819914E+03 -0.26599E-04 -0.23550E-06 20700 0.511E-03 0.172E-03
DAV: 9 -0.367065845683E+03 -0.25769E-04 -0.19361E-06 20664 0.371E-03 0.106E-03
DAV: 10 -0.367065866233E+03 -0.20551E-04 -0.18848E-06 20922 0.307E-03 0.737E-04
DAV: 11 -0.367065876708E+03 -0.10474E-04 -0.10672E-06 21516 0.217E-03 0.493E-04
DAV: 12 -0.367065881827E+03 -0.51191E-05 -0.66237E-07 21150 0.148E-03
62 F= -.36706588E+03 E0= -.36706975E+03 d E =-.684071E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367066023312E+03 -0.14660E-03 -0.11927E-01 25572 0.113E+00 0.864E-02
DAV: 2 -0.367066172731E+03 -0.14942E-03 -0.25272E-03 28476 0.153E-01 0.557E-02
DAV: 3 -0.367066139585E+03 0.33146E-04 -0.11899E-04 29604 0.414E-02 0.280E-02
DAV: 4 -0.367066136437E+03 0.31478E-05 -0.35859E-05 28740 0.229E-02
63 F= -.36706614E+03 E0= -.36707000E+03 d E =-.709532E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367069841940E+03 -0.37024E-02 -0.17949E+00 25536 0.433E+00 0.329E-01
DAV: 2 -0.367072307613E+03 -0.24657E-02 -0.37857E-02 28086 0.577E-01 0.208E-01
DAV: 3 -0.367071822382E+03 0.48523E-03 -0.14262E-03 30774 0.145E-01 0.108E-01
DAV: 4 -0.367071745122E+03 0.77260E-04 -0.56278E-04 30630 0.880E-02 0.294E-02
DAV: 5 -0.367071752368E+03 -0.72466E-05 -0.10531E-04 31212 0.375E-02 0.141E-02
DAV: 6 -0.367071759584E+03 -0.72159E-05 -0.11959E-05 22164 0.122E-02
64 F= -.36707176E+03 E0= -.36707563E+03 d E =-.562315E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367071986001E+03 -0.23363E-03 -0.54904E-01 25536 0.240E+00 0.181E-01
DAV: 2 -0.367072721283E+03 -0.73528E-03 -0.11581E-02 26922 0.320E-01 0.115E-01
DAV: 3 -0.367072573988E+03 0.14729E-03 -0.45161E-04 32136 0.809E-02 0.595E-02
DAV: 4 -0.367072558788E+03 0.15200E-04 -0.17186E-04 29238 0.497E-02 0.164E-02
DAV: 5 -0.367072567678E+03 -0.88899E-05 -0.32966E-05 28182 0.212E-02
65 F= -.36707257E+03 E0= -.36707643E+03 d E =-.643124E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367076231056E+03 -0.36723E-02 -0.20060E+00 25536 0.457E+00 0.332E-01
DAV: 2 -0.367079127917E+03 -0.28969E-02 -0.41040E-02 26526 0.597E-01 0.214E-01
DAV: 3 -0.367078683343E+03 0.44457E-03 -0.14016E-03 32250 0.148E-01 0.112E-01
DAV: 4 -0.367078638927E+03 0.44417E-04 -0.60217E-04 29646 0.860E-02 0.290E-02
DAV: 5 -0.367078651498E+03 -0.12571E-04 -0.10433E-04 30468 0.391E-02 0.138E-02
DAV: 6 -0.367078664986E+03 -0.13489E-04 -0.13130E-05 21540 0.124E-02 0.734E-03
DAV: 7 -0.367078683325E+03 -0.18339E-04 -0.41377E-06 20304 0.703E-03 0.274E-03
DAV: 8 -0.367078698507E+03 -0.15182E-04 -0.16625E-06 20808 0.428E-03 0.142E-03
DAV: 9 -0.367078711288E+03 -0.12781E-04 -0.11109E-06 20790 0.281E-03 0.906E-04
DAV: 10 -0.367078723111E+03 -0.11823E-04 -0.12945E-06 20400 0.253E-03 0.583E-04
DAV: 11 -0.367078727266E+03 -0.41552E-05 -0.52437E-07 21540 0.164E-03
66 F= -.36707873E+03 E0= -.36708259E+03 d E =-.615959E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367078705738E+03 0.17372E-04 -0.11576E+00 25536 0.347E+00 0.251E-01
DAV: 2 -0.367080367808E+03 -0.16621E-02 -0.23643E-02 26946 0.453E-01 0.162E-01
DAV: 3 -0.367080115740E+03 0.25207E-03 -0.80979E-04 32040 0.112E-01 0.854E-02
DAV: 4 -0.367080088145E+03 0.27594E-04 -0.34771E-04 29958 0.651E-02 0.220E-02
DAV: 5 -0.367080089883E+03 -0.17375E-05 -0.59583E-05 31080 0.297E-02
67 F= -.36708009E+03 E0= -.36708396E+03 d E =-.752220E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367083617537E+03 -0.35294E-02 -0.16656E+00 25536 0.416E+00 0.301E-01
DAV: 2 -0.367086076092E+03 -0.24586E-02 -0.34667E-02 27228 0.543E-01 0.194E-01
DAV: 3 -0.367085701845E+03 0.37425E-03 -0.11777E-03 31176 0.137E-01 0.103E-01
DAV: 4 -0.367085662906E+03 0.38939E-04 -0.47406E-04 31026 0.774E-02 0.280E-02
DAV: 5 -0.367085676254E+03 -0.13348E-04 -0.79178E-05 29640 0.341E-02 0.130E-02
DAV: 6 -0.367085691172E+03 -0.14918E-04 -0.10934E-05 19950 0.115E-02 0.653E-03
DAV: 7 -0.367085710459E+03 -0.19287E-04 -0.35175E-06 19962 0.689E-03 0.241E-03
DAV: 8 -0.367085727283E+03 -0.16825E-04 -0.15968E-06 20700 0.411E-03 0.132E-03
DAV: 9 -0.367085742332E+03 -0.15048E-04 -0.12292E-06 20664 0.294E-03 0.832E-04
DAV: 10 -0.367085756411E+03 -0.14080E-04 -0.15481E-06 20754 0.286E-03 0.597E-04
DAV: 11 -0.367085762263E+03 -0.58516E-05 -0.78709E-07 21540 0.205E-03
68 F= -.36708576E+03 E0= -.36708963E+03 d E =-.567238E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367085121814E+03 0.63460E-03 -0.24272E+00 25536 0.503E+00 0.363E-01
DAV: 2 -0.367088719618E+03 -0.35978E-02 -0.50528E-02 26688 0.656E-01 0.234E-01
DAV: 3 -0.367088179114E+03 0.54050E-03 -0.17200E-03 30696 0.165E-01 0.125E-01
DAV: 4 -0.367088114245E+03 0.64869E-04 -0.69863E-04 31266 0.938E-02 0.339E-02
DAV: 5 -0.367088122383E+03 -0.81375E-05 -0.11651E-04 31176 0.415E-02 0.157E-02
DAV: 6 -0.367088133968E+03 -0.11585E-04 -0.16214E-05 20502 0.139E-02 0.786E-03
DAV: 7 -0.367088149443E+03 -0.15475E-04 -0.42900E-06 19800 0.776E-03 0.290E-03
DAV: 8 -0.367088163886E+03 -0.14443E-04 -0.17240E-06 20628 0.447E-03 0.141E-03
DAV: 9 -0.367088176787E+03 -0.12901E-04 -0.10912E-06 20868 0.288E-03 0.878E-04
DAV: 10 -0.367088191205E+03 -0.14418E-04 -0.15434E-06 20610 0.294E-03 0.658E-04
DAV: 11 -0.367088197078E+03 -0.58732E-05 -0.73686E-07 21684 0.207E-03
69 F= -.36708820E+03 E0= -.36709206E+03 d E =-.810720E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367091881873E+03 -0.36907E-02 -0.17265E+00 25536 0.422E+00 0.304E-01
DAV: 2 -0.367094511814E+03 -0.26299E-02 -0.35976E-02 26004 0.550E-01 0.190E-01
DAV: 3 -0.367094185360E+03 0.32645E-03 -0.11388E-03 30408 0.133E-01 0.102E-01
DAV: 4 -0.367094165432E+03 0.19928E-04 -0.49223E-04 30018 0.785E-02 0.284E-02
DAV: 5 -0.367094173260E+03 -0.78276E-05 -0.78038E-05 30684 0.336E-02
70 F= -.36709417E+03 E0= -.36709804E+03 d E =-.597618E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367091412419E+03 0.27530E-02 -0.49225E+00 25536 0.712E+00 0.517E-01
DAV: 2 -0.367098975711E+03 -0.75633E-02 -0.10326E-01 26310 0.931E-01 0.321E-01
DAV: 3 -0.367098027148E+03 0.94856E-03 -0.32494E-03 30960 0.225E-01 0.174E-01
DAV: 4 -0.367097946131E+03 0.81017E-04 -0.14214E-03 29742 0.133E-01 0.485E-02
DAV: 5 -0.367097977815E+03 -0.31684E-04 -0.22603E-04 29736 0.571E-02 0.226E-02
DAV: 6 -0.367098008939E+03 -0.31124E-04 -0.35111E-05 27516 0.189E-02 0.112E-02
DAV: 7 -0.367098042970E+03 -0.34031E-04 -0.56625E-06 19926 0.932E-03 0.449E-03
DAV: 8 -0.367098073129E+03 -0.30160E-04 -0.31557E-06 20682 0.514E-03 0.197E-03
DAV: 9 -0.367098095152E+03 -0.22023E-04 -0.16125E-06 20886 0.314E-03 0.120E-03
DAV: 10 -0.367098122202E+03 -0.27050E-04 -0.31966E-06 20076 0.343E-03 0.929E-04
DAV: 11 -0.367098129751E+03 -0.75492E-05 -0.11007E-06 21780 0.224E-03
71 F= -.36709813E+03 E0= -.36710200E+03 d E =-.993267E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367101674120E+03 -0.35519E-02 -0.25944E+00 25536 0.517E+00 0.375E-01
DAV: 2 -0.367105553628E+03 -0.38795E-02 -0.54985E-02 26544 0.686E-01 0.235E-01
DAV: 3 -0.367105030674E+03 0.52295E-03 -0.17281E-03 30006 0.159E-01 0.126E-01
DAV: 4 -0.367104979290E+03 0.51384E-04 -0.79249E-04 30912 0.984E-02 0.337E-02
DAV: 5 -0.367104991506E+03 -0.12216E-04 -0.12008E-04 31560 0.426E-02 0.166E-02
DAV: 6 -0.367105003845E+03 -0.12340E-04 -0.18254E-05 20640 0.147E-02 0.804E-03
DAV: 7 -0.367105017932E+03 -0.14087E-04 -0.43025E-06 20076 0.731E-03 0.311E-03
DAV: 8 -0.367105030991E+03 -0.13059E-04 -0.16228E-06 20532 0.445E-03 0.136E-03
DAV: 9 -0.367105041784E+03 -0.10793E-04 -0.92947E-07 20820 0.260E-03 0.819E-04
DAV: 10 -0.367105052883E+03 -0.11099E-04 -0.11660E-06 20676 0.240E-03 0.609E-04
DAV: 11 -0.367105057119E+03 -0.42356E-05 -0.49324E-07 21564 0.162E-03
72 F= -.36710506E+03 E0= -.36710892E+03 d E =-.692737E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367100303517E+03 0.47494E-02 -0.70217E+00 25536 0.852E+00 0.620E-01
DAV: 2 -0.367110899850E+03 -0.10596E-01 -0.14987E-01 26394 0.113E+00 0.387E-01
DAV: 3 -0.367109466910E+03 0.14329E-02 -0.46945E-03 30024 0.264E-01 0.208E-01
DAV: 4 -0.367109290362E+03 0.17655E-03 -0.21901E-03 30864 0.164E-01 0.562E-02
DAV: 5 -0.367109317429E+03 -0.27067E-04 -0.33227E-04 30954 0.713E-02 0.275E-02
DAV: 6 -0.367109348050E+03 -0.30620E-04 -0.56293E-05 28668 0.245E-02 0.134E-02
DAV: 7 -0.367109380285E+03 -0.32235E-04 -0.71946E-06 19854 0.110E-02 0.554E-03
DAV: 8 -0.367109414310E+03 -0.34026E-04 -0.46953E-06 20136 0.698E-03 0.236E-03
DAV: 9 -0.367109441628E+03 -0.27318E-04 -0.23872E-06 20790 0.423E-03 0.118E-03
DAV: 10 -0.367109467697E+03 -0.26068E-04 -0.30923E-06 20562 0.394E-03 0.131E-03
DAV: 11 -0.367109476735E+03 -0.90381E-05 -0.13913E-06 21672 0.324E-03
73 F= -.36710948E+03 E0= -.36711334E+03 d E =-.113470E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367113220261E+03 -0.37526E-02 -0.16967E+00 25536 0.418E+00 0.311E-01
DAV: 2 -0.367115600977E+03 -0.23807E-02 -0.36073E-02 26286 0.550E-01 0.192E-01
DAV: 3 -0.367115229863E+03 0.37111E-03 -0.12217E-03 30198 0.132E-01 0.101E-01
DAV: 4 -0.367115196846E+03 0.33017E-04 -0.51608E-04 30660 0.801E-02 0.290E-02
DAV: 5 -0.367115208509E+03 -0.11663E-04 -0.77542E-05 29922 0.336E-02 0.137E-02
DAV: 6 -0.367115219502E+03 -0.10992E-04 -0.12759E-05 20538 0.122E-02 0.662E-03
DAV: 7 -0.367115231917E+03 -0.12415E-04 -0.28219E-06 20106 0.614E-03 0.232E-03
DAV: 8 -0.367115243075E+03 -0.11159E-04 -0.13478E-06 20712 0.357E-03 0.116E-03
DAV: 9 -0.367115252540E+03 -0.94649E-05 -0.73787E-07 20964 0.205E-03
74 F= -.36711525E+03 E0= -.36711912E+03 d E =-.577581E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367105062808E+03 0.10180E-01 -0.15251E+01 25536 0.125E+01 0.950E-01
DAV: 2 -0.367127168072E+03 -0.22105E-01 -0.33257E-01 26334 0.166E+00 0.575E-01
DAV: 3 -0.367123828632E+03 0.33394E-02 -0.11037E-02 30168 0.400E-01 0.312E-01
DAV: 4 -0.367123332327E+03 0.49631E-03 -0.49092E-03 31260 0.246E-01 0.903E-02
DAV: 5 -0.367123406635E+03 -0.74308E-04 -0.74818E-04 30156 0.105E-01 0.422E-02
DAV: 6 -0.367123488545E+03 -0.81910E-04 -0.13279E-04 28338 0.373E-02 0.207E-02
DAV: 7 -0.367123574867E+03 -0.86322E-04 -0.20501E-05 22452 0.181E-02 0.762E-03
DAV: 8 -0.367123654013E+03 -0.79146E-04 -0.97661E-06 20268 0.955E-03 0.378E-03
DAV: 9 -0.367123715340E+03 -0.61327E-04 -0.52608E-06 20880 0.569E-03 0.202E-03
DAV: 10 -0.367123789529E+03 -0.74189E-04 -0.10623E-05 21246 0.610E-03 0.222E-03
DAV: 11 -0.367123811961E+03 -0.22432E-04 -0.25695E-06 21840 0.453E-03 0.948E-04
DAV: 12 -0.367123824688E+03 -0.12728E-04 -0.19264E-06 20580 0.291E-03 0.111E-03
DAV: 13 -0.367123828114E+03 -0.34261E-05 -0.62593E-07 21972 0.214E-03
75 F= -.36712383E+03 E0= -.36712769E+03 d E =-.143514E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367128782427E+03 -0.49577E-02 -0.41365E+00 25536 0.652E+00 0.478E-01
DAV: 2 -0.367134873339E+03 -0.60909E-02 -0.88343E-02 26604 0.860E-01 0.294E-01
DAV: 3 -0.367134030091E+03 0.84325E-03 -0.29022E-03 30300 0.206E-01 0.156E-01
DAV: 4 -0.367133957645E+03 0.72446E-04 -0.13012E-03 30534 0.128E-01 0.450E-02
DAV: 5 -0.367133973883E+03 -0.16238E-04 -0.20566E-04 30156 0.563E-02 0.209E-02
DAV: 6 -0.367133992179E+03 -0.18296E-04 -0.34858E-05 27300 0.192E-02 0.107E-02
DAV: 7 -0.367134010884E+03 -0.18704E-04 -0.46491E-06 19944 0.934E-03 0.388E-03
DAV: 8 -0.367134028467E+03 -0.17584E-04 -0.28393E-06 20664 0.553E-03 0.197E-03
DAV: 9 -0.367134042033E+03 -0.13565E-04 -0.10604E-06 20844 0.334E-03 0.997E-04
DAV: 10 -0.367134059727E+03 -0.17694E-04 -0.22640E-06 20388 0.376E-03 0.146E-03
DAV: 11 -0.367134064739E+03 -0.50120E-05 -0.77492E-07 21876 0.290E-03
76 F= -.36713406E+03 E0= -.36713793E+03 d E =-.102366E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367117653993E+03 0.16406E-01 -0.19791E+01 25536 0.143E+01 0.106E+00
DAV: 2 -0.367147577803E+03 -0.29924E-01 -0.43321E-01 26874 0.190E+00 0.645E-01
DAV: 3 -0.367143447153E+03 0.41307E-02 -0.13978E-02 30828 0.457E-01 0.349E-01
DAV: 4 -0.367142888239E+03 0.55891E-03 -0.64408E-03 30732 0.283E-01 0.101E-01
DAV: 5 -0.367142955412E+03 -0.67173E-04 -0.10109E-03 29736 0.124E-01 0.465E-02
DAV: 6 -0.367143035854E+03 -0.80441E-04 -0.16886E-04 28404 0.422E-02 0.234E-02
DAV: 7 -0.367143118790E+03 -0.82936E-04 -0.23261E-05 22452 0.201E-02 0.832E-03
DAV: 8 -0.367143190745E+03 -0.71955E-04 -0.11556E-05 20310 0.113E-02 0.421E-03
DAV: 9 -0.367143244402E+03 -0.53658E-04 -0.52770E-06 20754 0.704E-03 0.215E-03
DAV: 10 -0.367143310303E+03 -0.65900E-04 -0.10113E-05 21330 0.762E-03 0.289E-03
DAV: 11 -0.367143330836E+03 -0.20533E-04 -0.28772E-06 21816 0.588E-03 0.114E-03
DAV: 12 -0.367143344096E+03 -0.13260E-04 -0.20178E-06 20502 0.350E-03 0.126E-03
DAV: 13 -0.367143350838E+03 -0.67427E-05 -0.88280E-07 21120 0.251E-03
77 F= -.36714335E+03 E0= -.36714722E+03 d E =-.195227E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367146004405E+03 -0.26603E-02 -0.54204E+00 25536 0.746E+00 0.553E-01
DAV: 2 -0.367153753832E+03 -0.77494E-02 -0.11566E-01 27402 0.984E-01 0.342E-01
DAV: 3 -0.367152513568E+03 0.12403E-02 -0.37124E-03 30264 0.241E-01 0.182E-01
DAV: 4 -0.367152398858E+03 0.11471E-03 -0.18578E-03 31140 0.151E-01 0.533E-02
DAV: 5 -0.367152421816E+03 -0.22957E-04 -0.27922E-04 29532 0.661E-02 0.244E-02
DAV: 6 -0.367152449765E+03 -0.27950E-04 -0.51662E-05 28374 0.234E-02 0.123E-02
DAV: 7 -0.367152475133E+03 -0.25368E-04 -0.64580E-06 20010 0.110E-02 0.446E-03
DAV: 8 -0.367152498967E+03 -0.23834E-04 -0.43007E-06 20436 0.672E-03 0.248E-03
DAV: 9 -0.367152517522E+03 -0.18555E-04 -0.16631E-06 20898 0.452E-03 0.114E-03
DAV: 10 -0.367152536997E+03 -0.19475E-04 -0.25829E-06 20556 0.405E-03 0.194E-03
DAV: 11 -0.367152543786E+03 -0.67892E-05 -0.10288E-06 21852 0.367E-03
78 F= -.36715254E+03 E0= -.36715641E+03 d E =-.919295E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367124032662E+03 0.28504E-01 -0.30487E+01 25536 0.177E+01 0.134E+00
DAV: 2 -0.367169006673E+03 -0.44974E-01 -0.67232E-01 26670 0.237E+00 0.813E-01
DAV: 3 -0.367162204573E+03 0.68021E-02 -0.21716E-02 30420 0.583E-01 0.444E-01
DAV: 4 -0.367161235637E+03 0.96894E-03 -0.11179E-02 31152 0.373E-01 0.132E-01
DAV: 5 -0.367161318181E+03 -0.82544E-04 -0.17018E-03 30594 0.165E-01 0.609E-02
DAV: 6 -0.367161452003E+03 -0.13382E-03 -0.33305E-04 28314 0.584E-02 0.301E-02
DAV: 7 -0.367161567457E+03 -0.11545E-03 -0.45228E-05 28002 0.274E-02 0.111E-02
DAV: 8 -0.367161670384E+03 -0.10293E-03 -0.15535E-05 20652 0.133E-02 0.541E-03
DAV: 9 -0.367161754757E+03 -0.84373E-04 -0.89496E-06 21246 0.878E-03 0.260E-03
DAV: 10 -0.367161844861E+03 -0.90103E-04 -0.12381E-05 21498 0.807E-03 0.333E-03
DAV: 11 -0.367161879032E+03 -0.34172E-04 -0.40542E-06 21588 0.646E-03 0.136E-03
DAV: 12 -0.367161897563E+03 -0.18531E-04 -0.29812E-06 20808 0.401E-03 0.115E-03
DAV: 13 -0.367161906263E+03 -0.87002E-05 -0.12117E-06 21360 0.263E-03
79 F= -.36716191E+03 E0= -.36716577E+03 d E =-.185554E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367162373485E+03 -0.47592E-03 -0.10654E+01 25536 0.105E+01 0.789E-01
DAV: 2 -0.367177818247E+03 -0.15445E-01 -0.23411E-01 26496 0.140E+00 0.477E-01
DAV: 3 -0.367175377687E+03 0.24406E-02 -0.77061E-03 30264 0.341E-01 0.259E-01
DAV: 4 -0.367175068462E+03 0.30923E-03 -0.37257E-03 31200 0.217E-01 0.780E-02
DAV: 5 -0.367175112916E+03 -0.44454E-04 -0.55727E-04 29262 0.926E-02 0.363E-02
DAV: 6 -0.367175170076E+03 -0.57161E-04 -0.11804E-04 28608 0.348E-02 0.180E-02
DAV: 7 -0.367175220015E+03 -0.49938E-04 -0.14362E-05 21432 0.171E-02 0.667E-03
DAV: 8 -0.367175267053E+03 -0.47039E-04 -0.10309E-05 20466 0.106E-02 0.395E-03
DAV: 9 -0.367175295414E+03 -0.28360E-04 -0.30709E-06 21096 0.634E-03 0.190E-03
DAV: 10 -0.367175333883E+03 -0.38470E-04 -0.61381E-06 19770 0.649E-03 0.289E-03
DAV: 11 -0.367175347244E+03 -0.13361E-04 -0.21330E-06 21660 0.494E-03 0.104E-03
DAV: 12 -0.367175358125E+03 -0.10881E-04 -0.22701E-06 20448 0.362E-03 0.112E-03
DAV: 13 -0.367175361306E+03 -0.31811E-05 -0.70595E-07 21804 0.217E-03
80 F= -.36717536E+03 E0= -.36717923E+03 d E =-.134550E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367149890156E+03 0.25468E-01 -0.26381E+01 25536 0.165E+01 0.126E+00
DAV: 2 -0.367189075190E+03 -0.39185E-01 -0.59449E-01 26742 0.223E+00 0.754E-01
DAV: 3 -0.367183030721E+03 0.60445E-02 -0.19395E-02 30828 0.545E-01 0.416E-01
DAV: 4 -0.367182116241E+03 0.91448E-03 -0.96394E-03 31428 0.349E-01 0.127E-01
DAV: 5 -0.367182210485E+03 -0.94245E-04 -0.14453E-03 29190 0.150E-01 0.587E-02
DAV: 6 -0.367182337604E+03 -0.12712E-03 -0.30689E-04 28668 0.561E-02 0.285E-02
DAV: 7 -0.367182449152E+03 -0.11155E-03 -0.41244E-05 28218 0.268E-02 0.105E-02
DAV: 8 -0.367182550459E+03 -0.10131E-03 -0.15531E-05 20292 0.137E-02 0.544E-03
DAV: 9 -0.367182630026E+03 -0.79566E-04 -0.94855E-06 21798 0.911E-03 0.275E-03
DAV: 10 -0.367182709372E+03 -0.79346E-04 -0.99415E-06 21366 0.767E-03 0.321E-03
DAV: 11 -0.367182741156E+03 -0.31784E-04 -0.33343E-06 21612 0.547E-03 0.143E-03
DAV: 12 -0.367182760100E+03 -0.18944E-04 -0.33172E-06 20388 0.418E-03 0.119E-03
DAV: 13 -0.367182765628E+03 -0.55279E-05 -0.89825E-07 21912 0.241E-03
81 F= -.36718277E+03 E0= -.36718663E+03 d E =-.208594E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367181642435E+03 0.11177E-02 -0.10678E+01 25536 0.105E+01 0.789E-01
DAV: 2 -0.367196966081E+03 -0.15324E-01 -0.23201E-01 26268 0.140E+00 0.474E-01
DAV: 3 -0.367194596060E+03 0.23700E-02 -0.76079E-03 30348 0.340E-01 0.254E-01
DAV: 4 -0.367194317924E+03 0.27814E-03 -0.35994E-03 31308 0.211E-01 0.751E-02
DAV: 5 -0.367194365323E+03 -0.47399E-04 -0.51165E-04 29202 0.886E-02 0.355E-02
DAV: 6 -0.367194420339E+03 -0.55017E-04 -0.99343E-05 28398 0.322E-02 0.174E-02
DAV: 7 -0.367194471108E+03 -0.50769E-04 -0.12050E-05 20868 0.150E-02 0.638E-03
DAV: 8 -0.367194517210E+03 -0.46102E-04 -0.88394E-06 20358 0.949E-03 0.342E-03
DAV: 9 -0.367194548064E+03 -0.30855E-04 -0.31140E-06 20832 0.598E-03 0.160E-03
DAV: 10 -0.367194579729E+03 -0.31664E-04 -0.45277E-06 20280 0.512E-03 0.242E-03
DAV: 11 -0.367194590485E+03 -0.10757E-04 -0.17706E-06 21852 0.477E-03 0.826E-04
DAV: 12 -0.367194600896E+03 -0.10411E-04 -0.17630E-06 20298 0.294E-03 0.855E-04
DAV: 13 -0.367194604479E+03 -0.35826E-05 -0.64377E-07 21612 0.179E-03
82 F= -.36719460E+03 E0= -.36719847E+03 d E =-.118389E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367133591453E+03 0.61009E-01 -0.56384E+01 25536 0.240E+01 0.187E+00
DAV: 2 -0.367219186759E+03 -0.85595E-01 -0.12986E+00 27120 0.330E+00 0.110E+00
DAV: 3 -0.367206316708E+03 0.12870E-01 -0.40761E-02 31032 0.803E-01 0.610E-01
DAV: 4 -0.367204299609E+03 0.20171E-02 -0.20394E-02 31188 0.499E-01 0.183E-01
DAV: 5 -0.367204504087E+03 -0.20448E-03 -0.28592E-03 29136 0.208E-01 0.839E-02
DAV: 6 -0.367204729987E+03 -0.22590E-03 -0.53541E-04 28344 0.755E-02 0.394E-02
DAV: 7 -0.367204936165E+03 -0.20618E-03 -0.76184E-05 29178 0.349E-02 0.143E-02
DAV: 8 -0.367205111015E+03 -0.17485E-03 -0.27223E-05 22914 0.170E-02 0.684E-03
DAV: 9 -0.367205246664E+03 -0.13565E-03 -0.13060E-05 21672 0.106E-02 0.351E-03
DAV: 10 -0.367205384268E+03 -0.13760E-03 -0.18059E-05 22668 0.910E-03 0.373E-03
DAV: 11 -0.367205437493E+03 -0.53225E-04 -0.56646E-06 21420 0.759E-03 0.162E-03
DAV: 12 -0.367205464993E+03 -0.27500E-04 -0.47797E-06 22008 0.462E-03 0.154E-03
DAV: 13 -0.367205474571E+03 -0.95781E-05 -0.97555E-07 21432 0.309E-03
83 F= -.36720547E+03 E0= -.36720934E+03 d E =-.227089E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367206555761E+03 -0.10908E-02 -0.15053E+01 25536 0.124E+01 0.988E-01
DAV: 2 -0.367225748568E+03 -0.19193E-01 -0.33069E-01 26934 0.167E+00 0.579E-01
DAV: 3 -0.367221643061E+03 0.41055E-02 -0.11877E-02 30372 0.426E-01 0.302E-01
DAV: 4 -0.367221062424E+03 0.58064E-03 -0.51775E-03 31680 0.248E-01 0.922E-02
DAV: 5 -0.367221157314E+03 -0.94890E-04 -0.69758E-04 29052 0.103E-01 0.424E-02
DAV: 6 -0.367221247961E+03 -0.90648E-04 -0.11784E-04 28464 0.372E-02 0.198E-02
DAV: 7 -0.367221341057E+03 -0.93096E-04 -0.19080E-05 22458 0.167E-02 0.689E-03
DAV: 8 -0.367221423369E+03 -0.82312E-04 -0.98804E-06 20034 0.104E-02 0.380E-03
DAV: 9 -0.367221489534E+03 -0.66164E-04 -0.64856E-06 20970 0.648E-03 0.207E-03
DAV: 10 -0.367221559005E+03 -0.69471E-04 -0.96470E-06 21534 0.692E-03 0.233E-03
DAV: 11 -0.367221579603E+03 -0.20598E-04 -0.24052E-06 21996 0.516E-03 0.120E-03
DAV: 12 -0.367221595726E+03 -0.16123E-04 -0.23190E-06 20556 0.363E-03 0.137E-03
DAV: 13 -0.367221600707E+03 -0.49820E-05 -0.72479E-07 21960 0.223E-03
84 F= -.36722160E+03 E0= -.36722547E+03 d E =-.161261E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367215277837E+03 0.63179E-02 -0.10726E+01 25536 0.105E+01 0.832E-01
DAV: 2 -0.367228729925E+03 -0.13452E-01 -0.23346E-01 26886 0.141E+00 0.488E-01
DAV: 3 -0.367225784653E+03 0.29453E-02 -0.84613E-03 30252 0.359E-01 0.253E-01
DAV: 4 -0.367225391817E+03 0.39284E-03 -0.36557E-03 31656 0.208E-01 0.775E-02
DAV: 5 -0.367225460527E+03 -0.68710E-04 -0.49012E-04 29040 0.862E-02 0.357E-02
DAV: 6 -0.367225528150E+03 -0.67623E-04 -0.83307E-05 28440 0.313E-02 0.167E-02
DAV: 7 -0.367225598658E+03 -0.70508E-04 -0.13159E-05 20898 0.141E-02 0.581E-03
DAV: 8 -0.367225661662E+03 -0.63004E-04 -0.80295E-06 20172 0.916E-03 0.332E-03
DAV: 9 -0.367225709389E+03 -0.47727E-04 -0.42680E-06 20676 0.570E-03 0.177E-03
DAV: 10 -0.367225763121E+03 -0.53732E-04 -0.78677E-06 21594 0.625E-03 0.226E-03
DAV: 11 -0.367225776567E+03 -0.13446E-04 -0.16463E-06 22128 0.458E-03 0.106E-03
DAV: 12 -0.367225790526E+03 -0.13959E-04 -0.19800E-06 20430 0.350E-03 0.140E-03
DAV: 13 -0.367225794895E+03 -0.43691E-05 -0.59290E-07 21864 0.204E-03
85 F= -.36722579E+03 E0= -.36722966E+03 d E =-.203203E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367227722031E+03 -0.19315E-02 -0.15499E+01 25536 0.126E+01 0.104E+00
DAV: 2 -0.367246086751E+03 -0.18365E-01 -0.34642E-01 26994 0.171E+00 0.596E-01
DAV: 3 -0.367241511876E+03 0.45749E-02 -0.13849E-02 30090 0.455E-01 0.307E-01
DAV: 4 -0.367240888410E+03 0.62347E-03 -0.53763E-03 31692 0.255E-01 0.100E-01
DAV: 5 -0.367240999207E+03 -0.11080E-03 -0.73337E-04 29052 0.102E-01 0.451E-02
DAV: 6 -0.367241098397E+03 -0.99190E-04 -0.11703E-04 28740 0.380E-02 0.205E-02
DAV: 7 -0.367241203601E+03 -0.10520E-03 -0.18513E-05 21264 0.165E-02 0.653E-03
DAV: 8 -0.367241288959E+03 -0.85358E-04 -0.11255E-05 20352 0.105E-02 0.392E-03
DAV: 9 -0.367241351669E+03 -0.62710E-04 -0.64234E-06 21768 0.709E-03 0.216E-03
DAV: 10 -0.367241417819E+03 -0.66150E-04 -0.89376E-06 21300 0.690E-03 0.226E-03
DAV: 11 -0.367241436752E+03 -0.18933E-04 -0.23283E-06 22020 0.501E-03 0.106E-03
DAV: 12 -0.367241449934E+03 -0.13182E-04 -0.20487E-06 20106 0.336E-03 0.133E-03
DAV: 13 -0.367241454292E+03 -0.43581E-05 -0.65692E-07 21816 0.223E-03
86 F= -.36724145E+03 E0= -.36724532E+03 d E =-.156594E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367233895408E+03 0.75545E-02 -0.14351E+01 25536 0.121E+01 0.999E-01
DAV: 2 -0.367250811153E+03 -0.16916E-01 -0.32076E-01 26916 0.165E+00 0.574E-01
DAV: 3 -0.367246549175E+03 0.42620E-02 -0.12922E-02 30942 0.437E-01 0.296E-01
DAV: 4 -0.367245959587E+03 0.58959E-03 -0.49268E-03 31764 0.244E-01 0.959E-02
DAV: 5 -0.367246066885E+03 -0.10730E-03 -0.66922E-04 28926 0.959E-02 0.435E-02
DAV: 6 -0.367246160676E+03 -0.93791E-04 -0.10539E-04 28716 0.365E-02 0.195E-02
DAV: 7 -0.367246259068E+03 -0.98392E-04 -0.16567E-05 20280 0.158E-02 0.623E-03
DAV: 8 -0.367246340128E+03 -0.81060E-04 -0.12094E-05 21090 0.104E-02 0.392E-03
DAV: 9 -0.367246398236E+03 -0.58108E-04 -0.51982E-06 20970 0.718E-03 0.212E-03
DAV: 10 -0.367246460475E+03 -0.62239E-04 -0.93154E-06 21294 0.689E-03 0.240E-03
DAV: 11 -0.367246476381E+03 -0.15907E-04 -0.19894E-06 22152 0.483E-03 0.106E-03
DAV: 12 -0.367246490147E+03 -0.13765E-04 -0.21683E-06 19962 0.354E-03 0.140E-03
DAV: 13 -0.367246494753E+03 -0.46060E-05 -0.66282E-07 21600 0.221E-03
87 F= -.36724649E+03 E0= -.36725036E+03 d E =-.206999E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367249234715E+03 -0.27446E-02 -0.17555E+01 25536 0.134E+01 0.110E+00
DAV: 2 -0.367269048254E+03 -0.19814E-01 -0.37995E-01 27564 0.180E+00 0.639E-01
DAV: 3 -0.367263823642E+03 0.52246E-02 -0.15447E-02 29820 0.487E-01 0.327E-01
DAV: 4 -0.367263181394E+03 0.64225E-03 -0.61625E-03 31656 0.261E-01 0.106E-01
DAV: 5 -0.367263299165E+03 -0.11777E-03 -0.76839E-04 28890 0.105E-01 0.472E-02
DAV: 6 -0.367263413960E+03 -0.11479E-03 -0.12254E-04 28596 0.391E-02 0.209E-02
DAV: 7 -0.367263528242E+03 -0.11428E-03 -0.20827E-05 22674 0.161E-02 0.680E-03
DAV: 8 -0.367263617168E+03 -0.88926E-04 -0.98624E-06 20376 0.928E-03 0.369E-03
DAV: 9 -0.367263691940E+03 -0.74772E-04 -0.75675E-06 21282 0.641E-03 0.192E-03
DAV: 10 -0.367263750150E+03 -0.58210E-04 -0.66604E-06 21672 0.510E-03 0.184E-03
DAV: 11 -0.367263771060E+03 -0.20910E-04 -0.21352E-06 21732 0.410E-03 0.965E-04
DAV: 12 -0.367263784558E+03 -0.13497E-04 -0.18705E-06 20502 0.279E-03 0.939E-04
DAV: 13 -0.367263788488E+03 -0.39303E-05 -0.59283E-07 21948 0.197E-03
88 F= -.36726379E+03 E0= -.36726765E+03 d E =-.172937E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367256346891E+03 0.74377E-02 -0.16369E+01 25536 0.129E+01 0.106E+00
DAV: 2 -0.367274589826E+03 -0.18243E-01 -0.35342E-01 27672 0.174E+00 0.618E-01
DAV: 3 -0.367269657907E+03 0.49319E-02 -0.14499E-02 29760 0.472E-01 0.315E-01
DAV: 4 -0.367269057338E+03 0.60057E-03 -0.57502E-03 31668 0.251E-01 0.102E-01
DAV: 5 -0.367269167814E+03 -0.11048E-03 -0.71440E-04 28782 0.101E-01 0.456E-02
DAV: 6 -0.367269277526E+03 -0.10971E-03 -0.11336E-04 28626 0.376E-02 0.201E-02
DAV: 7 -0.367269385742E+03 -0.10822E-03 -0.19249E-05 22284 0.155E-02 0.649E-03
DAV: 8 -0.367269469452E+03 -0.83710E-04 -0.93670E-06 20328 0.900E-03 0.356E-03
DAV: 9 -0.367269538038E+03 -0.68586E-04 -0.67746E-06 21396 0.611E-03 0.186E-03
DAV: 10 -0.367269593527E+03 -0.55488E-04 -0.61805E-06 21144 0.497E-03 0.177E-03
DAV: 11 -0.367269613526E+03 -0.19999E-04 -0.23027E-06 21660 0.404E-03 0.931E-04
DAV: 12 -0.367269626128E+03 -0.12603E-04 -0.17655E-06 20532 0.275E-03 0.911E-04
DAV: 13 -0.367269629806E+03 -0.36781E-05 -0.61015E-07 21948 0.193E-03
89 F= -.36726963E+03 E0= -.36727350E+03 d E =-.231351E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367271800221E+03 -0.21741E-02 -0.15786E+01 25536 0.127E+01 0.107E+00
DAV: 2 -0.367289143349E+03 -0.17343E-01 -0.34945E-01 27750 0.172E+00 0.617E-01
DAV: 3 -0.367283968450E+03 0.51749E-02 -0.14768E-02 30348 0.474E-01 0.319E-01
DAV: 4 -0.367283262925E+03 0.70552E-03 -0.57331E-03 31776 0.250E-01 0.107E-01
DAV: 5 -0.367283381129E+03 -0.11820E-03 -0.75316E-04 28812 0.104E-01 0.461E-02
DAV: 6 -0.367283497033E+03 -0.11590E-03 -0.11186E-04 28800 0.391E-02 0.203E-02
DAV: 7 -0.367283617871E+03 -0.12084E-03 -0.22361E-05 23730 0.160E-02 0.699E-03
DAV: 8 -0.367283715849E+03 -0.97978E-04 -0.87625E-06 20424 0.904E-03 0.377E-03
DAV: 9 -0.367283812305E+03 -0.96456E-04 -0.10461E-05 21690 0.677E-03 0.203E-03
DAV: 10 -0.367283881543E+03 -0.69238E-04 -0.79753E-06 21984 0.548E-03 0.176E-03
DAV: 11 -0.367283909052E+03 -0.27509E-04 -0.28908E-06 21348 0.414E-03 0.981E-04
DAV: 12 -0.367283921518E+03 -0.12467E-04 -0.17647E-06 21024 0.262E-03 0.762E-04
DAV: 13 -0.367283926079E+03 -0.45602E-05 -0.67511E-07 21744 0.186E-03
90 F= -.36728393E+03 E0= -.36728779E+03 d E =-.142963E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367283419383E+03 0.50214E-03 -0.22184E+00 25536 0.475E+00 0.394E-01
DAV: 2 -0.367285741687E+03 -0.23223E-02 -0.47547E-02 26820 0.639E-01 0.231E-01
DAV: 3 -0.367285014103E+03 0.72758E-03 -0.20948E-03 30276 0.176E-01 0.116E-01
DAV: 4 -0.367284935841E+03 0.78262E-04 -0.76573E-04 31356 0.917E-02 0.386E-02
DAV: 5 -0.367284955870E+03 -0.20029E-04 -0.99759E-05 28956 0.378E-02 0.169E-02
DAV: 6 -0.367284975058E+03 -0.19187E-04 -0.12961E-05 18828 0.141E-02 0.754E-03
DAV: 7 -0.367284996705E+03 -0.21647E-04 -0.45650E-06 19692 0.706E-03 0.255E-03
DAV: 8 -0.367285012891E+03 -0.16186E-04 -0.15305E-06 20652 0.392E-03 0.144E-03
DAV: 9 -0.367285029180E+03 -0.16289E-04 -0.13142E-06 20448 0.258E-03 0.842E-04
DAV: 10 -0.367285041826E+03 -0.12647E-04 -0.13409E-06 20880 0.224E-03 0.621E-04
DAV: 11 -0.367285047749E+03 -0.59223E-05 -0.64303E-07 21420 0.168E-03
91 F= -.36728505E+03 E0= -.36728891E+03 d E =-.154179E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367284926107E+03 0.11572E-03 -0.16795E+01 25536 0.131E+01 0.108E+00
DAV: 2 -0.367304626293E+03 -0.19700E-01 -0.37137E-01 27468 0.178E+00 0.638E-01
DAV: 3 -0.367299297042E+03 0.53293E-02 -0.15539E-02 30096 0.489E-01 0.330E-01
DAV: 4 -0.367298579894E+03 0.71715E-03 -0.60257E-03 31620 0.260E-01 0.111E-01
DAV: 5 -0.367298692189E+03 -0.11230E-03 -0.81602E-04 28632 0.105E-01 0.478E-02
DAV: 6 -0.367298798857E+03 -0.10667E-03 -0.11693E-04 29016 0.403E-02 0.210E-02
DAV: 7 -0.367298906974E+03 -0.10812E-03 -0.20317E-05 23922 0.160E-02 0.683E-03
DAV: 8 -0.367298990996E+03 -0.84023E-04 -0.92139E-06 20478 0.913E-03 0.366E-03
DAV: 9 -0.367299061301E+03 -0.70305E-04 -0.70919E-06 21162 0.626E-03 0.193E-03
DAV: 10 -0.367299116543E+03 -0.55242E-04 -0.57468E-06 20472 0.487E-03 0.163E-03
DAV: 11 -0.367299135644E+03 -0.19101E-04 -0.25182E-06 21528 0.360E-03 0.885E-04
DAV: 12 -0.367299147328E+03 -0.11684E-04 -0.17380E-06 20346 0.271E-03 0.716E-04
DAV: 13 -0.367299150501E+03 -0.31730E-05 -0.66025E-07 21816 0.174E-03
92 F= -.36729915E+03 E0= -.36730302E+03 d E =-.141028E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367297091444E+03 0.20559E-02 -0.51367E+00 25536 0.724E+00 0.593E-01
DAV: 2 -0.367302954540E+03 -0.58631E-02 -0.11121E-01 27174 0.975E-01 0.352E-01
DAV: 3 -0.367301308766E+03 0.16458E-02 -0.47677E-03 30294 0.269E-01 0.179E-01
DAV: 4 -0.367301110289E+03 0.19848E-03 -0.17825E-03 31392 0.142E-01 0.595E-02
DAV: 5 -0.367301151134E+03 -0.40845E-04 -0.24031E-04 28500 0.568E-02 0.259E-02
DAV: 6 -0.367301187814E+03 -0.36680E-04 -0.32513E-05 25092 0.217E-02 0.115E-02
DAV: 7 -0.367301224540E+03 -0.36726E-04 -0.65800E-06 19674 0.901E-03 0.366E-03
DAV: 8 -0.367301252640E+03 -0.28101E-04 -0.35003E-06 20598 0.547E-03 0.204E-03
DAV: 9 -0.367301276258E+03 -0.23618E-04 -0.19024E-06 20244 0.358E-03 0.104E-03
DAV: 10 -0.367301295587E+03 -0.19329E-04 -0.23665E-06 20568 0.293E-03 0.873E-04
DAV: 11 -0.367301302055E+03 -0.64683E-05 -0.80799E-07 21648 0.200E-03
93 F= -.36730130E+03 E0= -.36730517E+03 d E =-.162543E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367305255788E+03 -0.39602E-02 -0.11317E+01 25536 0.108E+01 0.894E-01
DAV: 2 -0.367317294109E+03 -0.12038E-01 -0.24231E-01 27474 0.145E+00 0.526E-01
DAV: 3 -0.367313539689E+03 0.37544E-02 -0.10785E-02 30024 0.403E-01 0.263E-01
DAV: 4 -0.367313075914E+03 0.46378E-03 -0.37823E-03 31644 0.206E-01 0.863E-02
DAV: 5 -0.367313161507E+03 -0.85593E-04 -0.48157E-04 28302 0.785E-02 0.380E-02
DAV: 6 -0.367313236854E+03 -0.75347E-04 -0.69312E-05 29148 0.314E-02 0.167E-02
DAV: 7 -0.367313314220E+03 -0.77367E-04 -0.13032E-05 19326 0.136E-02 0.548E-03
DAV: 8 -0.367313375207E+03 -0.60986E-04 -0.87948E-06 20484 0.905E-03 0.320E-03
DAV: 9 -0.367313420962E+03 -0.45756E-04 -0.41650E-06 19974 0.610E-03 0.164E-03
DAV: 10 -0.367313459655E+03 -0.38693E-04 -0.57212E-06 21630 0.533E-03 0.146E-03
DAV: 11 -0.367313472205E+03 -0.12550E-04 -0.13167E-06 21636 0.346E-03 0.762E-04
DAV: 12 -0.367313480659E+03 -0.84540E-05 -0.98409E-07 20430 0.216E-03
94 F= -.36731348E+03 E0= -.36731735E+03 d E =-.121786E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367313111675E+03 0.36053E-03 -0.23428E+00 25536 0.490E+00 0.403E-01
DAV: 2 -0.367315509091E+03 -0.23974E-02 -0.49090E-02 27456 0.653E-01 0.239E-01
DAV: 3 -0.367314723046E+03 0.78605E-03 -0.22505E-03 29976 0.182E-01 0.117E-01
DAV: 4 -0.367314652956E+03 0.70090E-04 -0.75843E-04 30996 0.920E-02 0.384E-02
DAV: 5 -0.367314674040E+03 -0.21084E-04 -0.95660E-05 28014 0.348E-02 0.170E-02
DAV: 6 -0.367314691697E+03 -0.17657E-04 -0.12379E-05 20622 0.140E-02 0.751E-03
DAV: 7 -0.367314710204E+03 -0.18507E-04 -0.38582E-06 19902 0.692E-03 0.251E-03
DAV: 8 -0.367314723577E+03 -0.13373E-04 -0.15781E-06 20544 0.424E-03 0.149E-03
DAV: 9 -0.367314736982E+03 -0.13405E-04 -0.11728E-06 20352 0.324E-03 0.868E-04
DAV: 10 -0.367314745239E+03 -0.82575E-05 -0.85037E-07 20820 0.229E-03
95 F= -.36731475E+03 E0= -.36731861E+03 d E =-.134432E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367320137961E+03 -0.54010E-02 -0.12271E+01 25536 0.112E+01 0.101E+00
DAV: 2 -0.367330262122E+03 -0.10124E-01 -0.27288E-01 27060 0.153E+00 0.555E-01
DAV: 3 -0.367325367842E+03 0.48943E-02 -0.13320E-02 29700 0.439E-01 0.276E-01
DAV: 4 -0.367324755476E+03 0.61237E-03 -0.48313E-03 31740 0.227E-01 0.973E-02
DAV: 5 -0.367324875760E+03 -0.12028E-03 -0.55454E-04 28620 0.873E-02 0.428E-02
DAV: 6 -0.367324994113E+03 -0.11835E-03 -0.90060E-05 28728 0.352E-02 0.180E-02
DAV: 7 -0.367325117617E+03 -0.12350E-03 -0.19556E-05 24150 0.145E-02 0.618E-03
DAV: 8 -0.367325217224E+03 -0.99606E-04 -0.85416E-06 20268 0.906E-03 0.370E-03
DAV: 9 -0.367325307750E+03 -0.90527E-04 -0.97856E-06 21054 0.678E-03 0.211E-03
DAV: 10 -0.367325375187E+03 -0.67436E-04 -0.75121E-06 21762 0.579E-03 0.162E-03
DAV: 11 -0.367325401836E+03 -0.26649E-04 -0.26514E-06 21300 0.398E-03 0.953E-04
DAV: 12 -0.367325413698E+03 -0.11862E-04 -0.15039E-06 20796 0.244E-03 0.584E-04
DAV: 13 -0.367325418581E+03 -0.48825E-05 -0.65255E-07 21408 0.162E-03
96 F= -.36732542E+03 E0= -.36732928E+03 d E =-.106733E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367325520057E+03 -0.10636E-03 -0.87070E-01 25536 0.298E+00 0.264E-01
DAV: 2 -0.367326190337E+03 -0.67028E-03 -0.18755E-02 26370 0.404E-01 0.148E-01
DAV: 3 -0.367325845596E+03 0.34474E-03 -0.96124E-04 29418 0.116E-01 0.711E-02
DAV: 4 -0.367325812194E+03 0.33402E-04 -0.32476E-04 31368 0.588E-02 0.249E-02
DAV: 5 -0.367325821763E+03 -0.95691E-05 -0.35218E-05 26142 0.221E-02
97 F= -.36732582E+03 E0= -.36732969E+03 d E =-.110765E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367335134758E+03 -0.93226E-02 -0.12557E+01 25536 0.113E+01 0.105E+00
DAV: 2 -0.367342840078E+03 -0.77053E-02 -0.27460E-01 26040 0.156E+00 0.581E-01
DAV: 3 -0.367337577721E+03 0.52624E-02 -0.16263E-02 29940 0.473E-01 0.277E-01
DAV: 4 -0.367336996366E+03 0.58135E-03 -0.48121E-03 31620 0.232E-01 0.101E-01
DAV: 5 -0.367337144345E+03 -0.14798E-03 -0.58451E-04 28038 0.890E-02 0.453E-02
DAV: 6 -0.367337293119E+03 -0.14877E-03 -0.96631E-05 29238 0.366E-02 0.194E-02
DAV: 7 -0.367337443118E+03 -0.15000E-03 -0.23122E-05 25086 0.159E-02 0.625E-03
DAV: 8 -0.367337544587E+03 -0.10147E-03 -0.85936E-06 20730 0.889E-03 0.377E-03
DAV: 9 -0.367337645702E+03 -0.10111E-03 -0.11708E-05 21078 0.704E-03 0.226E-03
DAV: 10 -0.367337708557E+03 -0.62855E-04 -0.62257E-06 21762 0.502E-03 0.148E-03
DAV: 11 -0.367337737088E+03 -0.28531E-04 -0.31923E-06 21264 0.350E-03 0.921E-04
DAV: 12 -0.367337747530E+03 -0.10442E-04 -0.12564E-06 20820 0.217E-03 0.432E-04
DAV: 13 -0.367337752948E+03 -0.54178E-05 -0.75360E-07 20682 0.157E-03
98 F= -.36733775E+03 E0= -.36734162E+03 d E =-.119312E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367338321562E+03 -0.57403E-03 -0.16022E+00 25536 0.405E+00 0.369E-01
DAV: 2 -0.367339252721E+03 -0.93116E-03 -0.34134E-02 25932 0.554E-01 0.208E-01
DAV: 3 -0.367338578343E+03 0.67438E-03 -0.21150E-03 30060 0.169E-01 0.962E-02
DAV: 4 -0.367338519671E+03 0.58672E-04 -0.58352E-04 31260 0.811E-02 0.351E-02
DAV: 5 -0.367338537940E+03 -0.18269E-04 -0.70983E-05 28092 0.308E-02 0.157E-02
DAV: 6 -0.367338555751E+03 -0.17811E-04 -0.98643E-06 19200 0.127E-02 0.680E-03
DAV: 7 -0.367338574933E+03 -0.19181E-04 -0.39329E-06 20022 0.651E-03 0.227E-03
DAV: 8 -0.367338586981E+03 -0.12048E-04 -0.11465E-06 20616 0.352E-03 0.133E-03
DAV: 9 -0.367338601834E+03 -0.14853E-04 -0.14301E-06 20094 0.296E-03 0.954E-04
DAV: 10 -0.367338608983E+03 -0.71486E-05 -0.69587E-07 20976 0.195E-03
99 F= -.36733861E+03 E0= -.36734247E+03 d E =-.127872E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367351627223E+03 -0.13025E-01 -0.11787E+01 25536 0.110E+01 0.107E+00
DAV: 2 -0.367356256105E+03 -0.46289E-02 -0.25951E-01 26412 0.154E+00 0.586E-01
DAV: 3 -0.367350733004E+03 0.55231E-02 -0.17370E-02 30108 0.490E-01 0.271E-01
DAV: 4 -0.367350171172E+03 0.56183E-03 -0.47247E-03 31656 0.228E-01 0.103E-01
DAV: 5 -0.367350291416E+03 -0.12024E-03 -0.57818E-04 28026 0.880E-02 0.457E-02
DAV: 6 -0.367350431180E+03 -0.13976E-03 -0.97139E-05 28902 0.369E-02 0.187E-02
DAV: 7 -0.367350558734E+03 -0.12755E-03 -0.19461E-05 22350 0.150E-02 0.613E-03
DAV: 8 -0.367350653135E+03 -0.94401E-04 -0.88281E-06 20490 0.862E-03 0.364E-03
DAV: 9 -0.367350740785E+03 -0.87650E-04 -0.92951E-06 20550 0.667E-03 0.208E-03
DAV: 10 -0.367350800994E+03 -0.60209E-04 -0.64653E-06 21732 0.507E-03 0.168E-03
DAV: 11 -0.367350825702E+03 -0.24707E-04 -0.23894E-06 21204 0.356E-03 0.941E-04
DAV: 12 -0.367350838659E+03 -0.12958E-04 -0.17156E-06 20640 0.249E-03 0.661E-04
DAV: 13 -0.367350843163E+03 -0.45040E-05 -0.62334E-07 21576 0.172E-03
100 F= -.36735084E+03 E0= -.36735471E+03 d E =-.122342E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367352650969E+03 -0.18123E-02 -0.29954E+00 25536 0.556E+00 0.534E-01
DAV: 2 -0.367353744408E+03 -0.10934E-02 -0.64650E-02 25968 0.772E-01 0.296E-01
DAV: 3 -0.367352318577E+03 0.14258E-02 -0.44847E-03 30132 0.246E-01 0.134E-01
DAV: 4 -0.367352194641E+03 0.12394E-03 -0.11574E-03 31560 0.113E-01 0.512E-02
DAV: 5 -0.367352230148E+03 -0.35508E-04 -0.14253E-04 27948 0.434E-02 0.226E-02
DAV: 6 -0.367352269985E+03 -0.39837E-04 -0.21671E-05 21672 0.183E-02 0.932E-03
DAV: 7 -0.367352307233E+03 -0.37248E-04 -0.62847E-06 19920 0.827E-03 0.313E-03
DAV: 8 -0.367352332093E+03 -0.24860E-04 -0.23486E-06 20412 0.456E-03 0.184E-03
DAV: 9 -0.367352360047E+03 -0.27954E-04 -0.24519E-06 20076 0.372E-03 0.112E-03
DAV: 10 -0.367352376402E+03 -0.16355E-04 -0.16732E-06 20712 0.265E-03 0.805E-04
DAV: 11 -0.367352386359E+03 -0.99574E-05 -0.11727E-06 20676 0.231E-03
101 F= -.36735239E+03 E0= -.36735625E+03 d E =-.137774E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367364988579E+03 -0.12612E-01 -0.11183E+01 25536 0.107E+01 0.109E+00
DAV: 2 -0.367368341242E+03 -0.33527E-02 -0.26296E-01 27750 0.153E+00 0.569E-01
DAV: 3 -0.367362374140E+03 0.59671E-02 -0.17126E-02 31236 0.484E-01 0.269E-01
DAV: 4 -0.367361759163E+03 0.61498E-03 -0.52047E-03 31632 0.232E-01 0.108E-01
DAV: 5 -0.367361911317E+03 -0.15215E-03 -0.60976E-04 28290 0.884E-02 0.494E-02
DAV: 6 -0.367362061605E+03 -0.15029E-03 -0.11059E-04 28776 0.429E-02 0.185E-02
DAV: 7 -0.367362198011E+03 -0.13641E-03 -0.24858E-05 26610 0.162E-02 0.658E-03
DAV: 8 -0.367362293982E+03 -0.95971E-04 -0.92126E-06 20772 0.957E-03 0.417E-03
DAV: 9 -0.367362396314E+03 -0.10233E-03 -0.10540E-05 20760 0.729E-03 0.247E-03
DAV: 10 -0.367362467529E+03 -0.71215E-04 -0.82075E-06 21900 0.598E-03 0.163E-03
DAV: 11 -0.367362498645E+03 -0.31116E-04 -0.32097E-06 21000 0.397E-03 0.115E-03
DAV: 12 -0.367362510748E+03 -0.12103E-04 -0.14354E-06 20988 0.241E-03 0.550E-04
DAV: 13 -0.367362518565E+03 -0.78173E-05 -0.10350E-06 20796 0.191E-03
102 F= -.36736252E+03 E0= -.36736638E+03 d E =-.101322E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367362879346E+03 -0.36860E-03 -0.40788E-01 25536 0.205E+00 0.205E-01
DAV: 2 -0.367362981099E+03 -0.10175E-03 -0.92772E-03 27270 0.289E-01 0.108E-01
DAV: 3 -0.367362763882E+03 0.21722E-03 -0.63402E-04 30702 0.917E-02 0.497E-02
DAV: 4 -0.367362745678E+03 0.18204E-04 -0.18024E-04 30720 0.433E-02 0.200E-02
DAV: 5 -0.367362751936E+03 -0.62581E-05 -0.19713E-05 22560 0.163E-02
103 F= -.36736275E+03 E0= -.36736662E+03 d E =-.103656E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367377042251E+03 -0.14297E-01 -0.88103E+00 25536 0.958E+00 0.977E-01
DAV: 2 -0.367378438325E+03 -0.13961E-02 -0.19986E-01 25782 0.137E+00 0.516E-01
DAV: 3 -0.367373701705E+03 0.47366E-02 -0.14220E-02 29700 0.445E-01 0.241E-01
DAV: 4 -0.367373253976E+03 0.44773E-03 -0.44195E-03 31536 0.216E-01 0.956E-02
DAV: 5 -0.367373391028E+03 -0.13705E-03 -0.50340E-04 27900 0.816E-02 0.444E-02
DAV: 6 -0.367373523532E+03 -0.13250E-03 -0.89237E-05 28866 0.372E-02 0.168E-02
DAV: 7 -0.367373638244E+03 -0.11471E-03 -0.17510E-05 20898 0.143E-02 0.548E-03
DAV: 8 -0.367373714391E+03 -0.76147E-04 -0.79240E-06 20646 0.873E-03 0.347E-03
DAV: 9 -0.367373784438E+03 -0.70047E-04 -0.72342E-06 20814 0.676E-03 0.193E-03
DAV: 10 -0.367373832907E+03 -0.48469E-04 -0.50335E-06 20544 0.521E-03 0.140E-03
DAV: 11 -0.367373854238E+03 -0.21331E-04 -0.29421E-06 20928 0.358E-03 0.871E-04
DAV: 12 -0.367373862997E+03 -0.87591E-05 -0.10987E-06 20736 0.218E-03
104 F= -.36737386E+03 E0= -.36737773E+03 d E =-.111111E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367378986262E+03 -0.51320E-02 -0.67776E+00 25536 0.840E+00 0.857E-01
DAV: 2 -0.367380032549E+03 -0.10463E-02 -0.15315E-01 25830 0.120E+00 0.453E-01
DAV: 3 -0.367376380886E+03 0.36517E-02 -0.11010E-02 29634 0.391E-01 0.211E-01
DAV: 4 -0.367376030742E+03 0.35014E-03 -0.33923E-03 31500 0.189E-01 0.835E-02
DAV: 5 -0.367376118992E+03 -0.88250E-04 -0.38700E-04 28056 0.714E-02 0.389E-02
DAV: 6 -0.367376208160E+03 -0.89168E-04 -0.67146E-05 28530 0.323E-02 0.147E-02
DAV: 7 -0.367376284994E+03 -0.76834E-04 -0.11848E-05 19782 0.123E-02 0.470E-03
DAV: 8 -0.367376336250E+03 -0.51256E-04 -0.62332E-06 20652 0.750E-03 0.296E-03
DAV: 9 -0.367376384343E+03 -0.48092E-04 -0.41334E-06 19536 0.567E-03 0.158E-03
DAV: 10 -0.367376419298E+03 -0.34955E-04 -0.42371E-06 20484 0.448E-03 0.122E-03
DAV: 11 -0.367376435491E+03 -0.16193E-04 -0.21671E-06 20880 0.319E-03 0.699E-04
DAV: 12 -0.367376442138E+03 -0.66470E-05 -0.98923E-07 20664 0.191E-03
105 F= -.36737644E+03 E0= -.36738031E+03 d E =-.136902E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367389817306E+03 -0.13382E-01 -0.66237E+00 25536 0.830E+00 0.887E-01
DAV: 2 -0.367389336919E+03 0.48039E-03 -0.15214E-01 27486 0.120E+00 0.459E-01
DAV: 3 -0.367385396788E+03 0.39401E-02 -0.11629E-02 29880 0.404E-01 0.213E-01
DAV: 4 -0.367385018731E+03 0.37806E-03 -0.35424E-03 31584 0.190E-01 0.857E-02
DAV: 5 -0.367385105907E+03 -0.87177E-04 -0.40207E-04 28098 0.731E-02 0.398E-02
DAV: 6 -0.367385205774E+03 -0.99867E-04 -0.72945E-05 28500 0.334E-02 0.148E-02
DAV: 7 -0.367385289239E+03 -0.83466E-04 -0.12382E-05 19650 0.125E-02 0.493E-03
DAV: 8 -0.367385349644E+03 -0.60404E-04 -0.70730E-06 20400 0.743E-03 0.305E-03
DAV: 9 -0.367385403774E+03 -0.54130E-04 -0.44582E-06 19884 0.533E-03 0.165E-03
DAV: 10 -0.367385447071E+03 -0.43298E-04 -0.56368E-06 21510 0.445E-03 0.132E-03
DAV: 11 -0.367385465601E+03 -0.18530E-04 -0.17645E-06 21096 0.294E-03 0.734E-04
DAV: 12 -0.367385474746E+03 -0.91451E-05 -0.10630E-06 20520 0.190E-03
106 F= -.36738547E+03 E0= -.36738934E+03 d E =-.903261E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367396495874E+03 -0.11030E-01 -0.10451E+01 25536 0.104E+01 0.112E+00
DAV: 2 -0.367395647646E+03 0.84823E-03 -0.24192E-01 27456 0.151E+00 0.578E-01
DAV: 3 -0.367389418849E+03 0.62288E-02 -0.18341E-02 29550 0.509E-01 0.269E-01
DAV: 4 -0.367388804530E+03 0.61432E-03 -0.57319E-03 31572 0.241E-01 0.109E-01
DAV: 5 -0.367388932050E+03 -0.12752E-03 -0.64431E-04 28110 0.934E-02 0.506E-02
DAV: 6 -0.367389079391E+03 -0.14734E-03 -0.11819E-04 28512 0.424E-02 0.187E-02
DAV: 7 -0.367389202456E+03 -0.12307E-03 -0.21227E-05 23760 0.157E-02 0.632E-03
DAV: 8 -0.367389289996E+03 -0.87539E-04 -0.85419E-06 20292 0.886E-03 0.377E-03
DAV: 9 -0.367389371395E+03 -0.81399E-04 -0.82401E-06 20898 0.646E-03 0.210E-03
DAV: 10 -0.367389431872E+03 -0.60478E-04 -0.63221E-06 21780 0.515E-03 0.155E-03
DAV: 11 -0.367389459255E+03 -0.27383E-04 -0.25320E-06 20940 0.346E-03 0.953E-04
DAV: 12 -0.367389472629E+03 -0.13374E-04 -0.15968E-06 20604 0.233E-03 0.486E-04
DAV: 13 -0.367389479105E+03 -0.64759E-05 -0.80300E-07 20988 0.163E-03
107 F= -.36738948E+03 E0= -.36739334E+03 d E =-.130370E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367406451386E+03 -0.16979E-01 -0.77053E+00 25536 0.891E+00 0.100E+00
DAV: 2 -0.367404556120E+03 0.18953E-02 -0.18736E-01 27780 0.131E+00 0.498E-01
DAV: 3 -0.367399506499E+03 0.50496E-02 -0.14378E-02 30984 0.443E-01 0.230E-01
DAV: 4 -0.367398984938E+03 0.52156E-03 -0.44003E-03 31608 0.208E-01 0.956E-02
DAV: 5 -0.367399095161E+03 -0.11022E-03 -0.47477E-04 28410 0.798E-02 0.455E-02
DAV: 6 -0.367399233689E+03 -0.13853E-03 -0.96486E-05 28434 0.390E-02 0.163E-02
DAV: 7 -0.367399348380E+03 -0.11469E-03 -0.18510E-05 21990 0.149E-02 0.560E-03
DAV: 8 -0.367399433019E+03 -0.84640E-04 -0.86490E-06 20106 0.853E-03 0.368E-03
DAV: 9 -0.367399514079E+03 -0.81059E-04 -0.82647E-06 20952 0.622E-03 0.205E-03
DAV: 10 -0.367399575012E+03 -0.60934E-04 -0.66245E-06 20610 0.527E-03 0.147E-03
DAV: 11 -0.367399596518E+03 -0.21505E-04 -0.28900E-06 21432 0.337E-03 0.909E-04
DAV: 12 -0.367399607718E+03 -0.11201E-04 -0.14607E-06 20568 0.230E-03 0.445E-04
DAV: 13 -0.367399613163E+03 -0.54447E-05 -0.86087E-07 21012 0.160E-03
108 F= -.36739961E+03 E0= -.36740348E+03 d E =-.101341E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367402411969E+03 -0.28043E-02 -0.18060E+00 25536 0.431E+00 0.481E-01
DAV: 2 -0.367401931065E+03 0.48090E-03 -0.43250E-02 27480 0.633E-01 0.241E-01
DAV: 3 -0.367400741268E+03 0.11898E-02 -0.33969E-03 31050 0.214E-01 0.110E-01
DAV: 4 -0.367400620819E+03 0.12045E-03 -0.10123E-03 31524 0.999E-02 0.456E-02
DAV: 5 -0.367400648940E+03 -0.28122E-04 -0.10851E-04 28326 0.380E-02 0.218E-02
DAV: 6 -0.367400684340E+03 -0.35399E-04 -0.20089E-05 21426 0.187E-02 0.778E-03
DAV: 7 -0.367400714546E+03 -0.30207E-04 -0.53114E-06 20202 0.788E-03 0.285E-03
DAV: 8 -0.367400735342E+03 -0.20796E-04 -0.21712E-06 20508 0.438E-03 0.185E-03
DAV: 9 -0.367400759955E+03 -0.24613E-04 -0.21006E-06 20106 0.353E-03 0.114E-03
DAV: 10 -0.367400774908E+03 -0.14954E-04 -0.14967E-06 20676 0.261E-03 0.742E-04
DAV: 11 -0.367400783656E+03 -0.87474E-05 -0.10187E-06 20772 0.221E-03
109 F= -.36740078E+03 E0= -.36740465E+03 d E =-.113046E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367418342862E+03 -0.17568E-01 -0.60375E+00 25536 0.790E+00 0.912E-01
DAV: 2 -0.367414202862E+03 0.41400E-02 -0.13732E-01 26250 0.117E+00 0.466E-01
DAV: 3 -0.367409918363E+03 0.42845E-02 -0.13747E-02 29682 0.427E-01 0.205E-01
DAV: 4 -0.367409522125E+03 0.39624E-03 -0.32138E-03 31488 0.187E-01 0.859E-02
DAV: 5 -0.367409606308E+03 -0.84184E-04 -0.41793E-04 27996 0.728E-02 0.393E-02
DAV: 6 -0.367409723884E+03 -0.11758E-03 -0.74031E-05 28614 0.340E-02 0.151E-02
DAV: 7 -0.367409826982E+03 -0.10310E-03 -0.15210E-05 19560 0.133E-02 0.541E-03
DAV: 8 -0.367409902255E+03 -0.75274E-04 -0.80892E-06 20118 0.784E-03 0.324E-03
DAV: 9 -0.367409981255E+03 -0.79000E-04 -0.89571E-06 20688 0.649E-03 0.212E-03
DAV: 10 -0.367410018557E+03 -0.37303E-04 -0.33504E-06 20892 0.424E-03 0.130E-03
DAV: 11 -0.367410043259E+03 -0.24702E-04 -0.35462E-06 20178 0.384E-03 0.113E-03
DAV: 12 -0.367410048868E+03 -0.56086E-05 -0.82104E-07 21888 0.219E-03
110 F= -.36741005E+03 E0= -.36741391E+03 d E =-.926521E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367416543334E+03 -0.65001E-02 -0.32012E+00 25536 0.576E+00 0.663E-01
DAV: 2 -0.367414286605E+03 0.22567E-02 -0.72258E-02 25914 0.847E-01 0.340E-01
DAV: 3 -0.367412002074E+03 0.22845E-02 -0.73678E-03 29616 0.312E-01 0.148E-01
DAV: 4 -0.367411791301E+03 0.21077E-03 -0.16868E-03 31404 0.136E-01 0.623E-02
DAV: 5 -0.367411837841E+03 -0.46540E-04 -0.22699E-04 28032 0.536E-02 0.286E-02
DAV: 6 -0.367411902608E+03 -0.64767E-04 -0.37641E-05 24042 0.249E-02 0.111E-02
DAV: 7 -0.367411961669E+03 -0.59061E-04 -0.10377E-05 19638 0.108E-02 0.411E-03
DAV: 8 -0.367411998201E+03 -0.36532E-04 -0.37054E-06 20496 0.589E-03 0.247E-03
DAV: 9 -0.367412046744E+03 -0.48543E-04 -0.54472E-06 19344 0.581E-03 0.201E-03
DAV: 10 -0.367412064187E+03 -0.17443E-04 -0.20281E-06 21180 0.365E-03 0.115E-03
DAV: 11 -0.367412081408E+03 -0.17221E-04 -0.29818E-06 19968 0.422E-03 0.152E-03
DAV: 12 -0.367412084343E+03 -0.29349E-05 -0.73046E-07 21912 0.233E-03
111 F= -.36741208E+03 E0= -.36741595E+03 d E =-.113007E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367434129855E+03 -0.22048E-01 -0.81321E+00 25536 0.913E+00 0.107E+00
DAV: 2 -0.367427730773E+03 0.63991E-02 -0.18554E-01 26412 0.135E+00 0.532E-01
DAV: 3 -0.367421755107E+03 0.59757E-02 -0.18887E-02 29598 0.494E-01 0.234E-01
DAV: 4 -0.367421215709E+03 0.53940E-03 -0.42609E-03 31476 0.219E-01 0.102E-01
DAV: 5 -0.367421334975E+03 -0.11927E-03 -0.53885E-04 27798 0.809E-02 0.472E-02
DAV: 6 -0.367421495968E+03 -0.16099E-03 -0.99545E-05 28644 0.409E-02 0.173E-02
DAV: 7 -0.367421634716E+03 -0.13875E-03 -0.23829E-05 24252 0.160E-02 0.701E-03
DAV: 8 -0.367421736589E+03 -0.10187E-03 -0.98532E-06 20124 0.105E-02 0.409E-03
DAV: 9 -0.367421847095E+03 -0.11051E-03 -0.14478E-05 21444 0.858E-03 0.334E-03
DAV: 10 -0.367421895745E+03 -0.48650E-04 -0.42666E-06 21024 0.614E-03 0.167E-03
DAV: 11 -0.367421935448E+03 -0.39703E-04 -0.68808E-06 21168 0.578E-03 0.215E-03
DAV: 12 -0.367421943697E+03 -0.82491E-05 -0.99909E-07 21900 0.337E-03
112 F= -.36742194E+03 E0= -.36742581E+03 d E =-.985935E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367426096638E+03 -0.41612E-02 -0.20113E+00 25536 0.454E+00 0.531E-01
DAV: 2 -0.367424483899E+03 0.16127E-02 -0.45312E-02 25668 0.670E-01 0.265E-01
DAV: 3 -0.367422992727E+03 0.14912E-02 -0.47483E-03 29448 0.246E-01 0.115E-01
DAV: 4 -0.367422854340E+03 0.13839E-03 -0.10350E-03 31512 0.108E-01 0.499E-02
DAV: 5 -0.367422888364E+03 -0.34024E-04 -0.13313E-04 27768 0.401E-02 0.232E-02
DAV: 6 -0.367422934282E+03 -0.45918E-04 -0.22188E-05 21624 0.203E-02 0.855E-03
DAV: 7 -0.367422973925E+03 -0.39643E-04 -0.72479E-06 20022 0.905E-03 0.364E-03
DAV: 8 -0.367423000064E+03 -0.26139E-04 -0.27123E-06 20376 0.545E-03 0.217E-03
DAV: 9 -0.367423036515E+03 -0.36450E-04 -0.41786E-06 19776 0.539E-03 0.212E-03
DAV: 10 -0.367423047859E+03 -0.11345E-04 -0.12451E-06 21492 0.323E-03 0.117E-03
DAV: 11 -0.367423063122E+03 -0.15263E-04 -0.24571E-06 19914 0.404E-03 0.135E-03
DAV: 12 -0.367423066420E+03 -0.32976E-05 -0.62121E-07 21744 0.219E-03
113 F= -.36742307E+03 E0= -.36742693E+03 d E =-.109821E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367443689407E+03 -0.20626E-01 -0.93894E+00 25536 0.982E+00 0.113E+00
DAV: 2 -0.367438987446E+03 0.47020E-02 -0.22129E-01 27390 0.146E+00 0.561E-01
DAV: 3 -0.367432324109E+03 0.66633E-02 -0.20206E-02 29994 0.516E-01 0.253E-01
DAV: 4 -0.367431642148E+03 0.68196E-03 -0.49890E-03 31488 0.234E-01 0.110E-01
DAV: 5 -0.367431787121E+03 -0.14497E-03 -0.69353E-04 27966 0.896E-02 0.521E-02
DAV: 6 -0.367431959990E+03 -0.17287E-03 -0.12940E-04 30060 0.475E-02 0.197E-02
DAV: 7 -0.367432107949E+03 -0.14796E-03 -0.31445E-05 26292 0.187E-02 0.763E-03
DAV: 8 -0.367432198837E+03 -0.90888E-04 -0.10945E-05 21960 0.109E-02 0.452E-03
DAV: 9 -0.367432307932E+03 -0.10910E-03 -0.12691E-05 20682 0.903E-03 0.350E-03
DAV: 10 -0.367432361434E+03 -0.53502E-04 -0.48723E-06 20706 0.622E-03 0.165E-03
DAV: 11 -0.367432397992E+03 -0.36558E-04 -0.61650E-06 21420 0.540E-03 0.201E-03
DAV: 12 -0.367432406191E+03 -0.81984E-05 -0.86469E-07 21924 0.315E-03
114 F= -.36743241E+03 E0= -.36743627E+03 d E =-.933977E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367436890243E+03 -0.44923E-02 -0.27812E+00 25536 0.534E+00 0.610E-01
DAV: 2 -0.367435422737E+03 0.14675E-02 -0.64402E-02 25962 0.792E-01 0.306E-01
DAV: 3 -0.367433452841E+03 0.19699E-02 -0.60318E-03 29502 0.281E-01 0.136E-01
DAV: 4 -0.367433251391E+03 0.20145E-03 -0.14545E-03 31512 0.127E-01 0.587E-02
DAV: 5 -0.367433297923E+03 -0.46532E-04 -0.19867E-04 27792 0.484E-02 0.279E-02
DAV: 6 -0.367433354024E+03 -0.56101E-04 -0.34092E-05 23610 0.250E-02 0.106E-02
DAV: 7 -0.367433402526E+03 -0.48502E-04 -0.93966E-06 20130 0.106E-02 0.421E-03
DAV: 8 -0.367433431988E+03 -0.29462E-04 -0.38131E-06 20508 0.629E-03 0.259E-03
DAV: 9 -0.367433472392E+03 -0.40404E-04 -0.46836E-06 19410 0.604E-03 0.225E-03
DAV: 10 -0.367433488354E+03 -0.15962E-04 -0.18713E-06 20988 0.377E-03 0.114E-03
DAV: 11 -0.367433503037E+03 -0.14682E-04 -0.23653E-06 20136 0.383E-03 0.130E-03
DAV: 12 -0.367433506327E+03 -0.32907E-05 -0.61415E-07 21876 0.216E-03
115 F= -.36743351E+03 E0= -.36743737E+03 d E =-.104399E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367446106504E+03 -0.12603E-01 -0.35279E+00 25536 0.603E+00 0.697E-01
DAV: 2 -0.367443612093E+03 0.24944E-02 -0.78432E-02 26130 0.881E-01 0.357E-01
DAV: 3 -0.367440978608E+03 0.26335E-02 -0.81464E-03 29556 0.330E-01 0.157E-01
DAV: 4 -0.367440717637E+03 0.26097E-03 -0.18742E-03 31560 0.146E-01 0.673E-02
DAV: 5 -0.367440773217E+03 -0.55580E-04 -0.27467E-04 27792 0.568E-02 0.313E-02
DAV: 6 -0.367440842689E+03 -0.69472E-04 -0.43455E-05 25158 0.275E-02 0.118E-02
DAV: 7 -0.367440903041E+03 -0.60352E-04 -0.11191E-05 19944 0.114E-02 0.461E-03
DAV: 8 -0.367440939769E+03 -0.36727E-04 -0.42896E-06 20478 0.656E-03 0.272E-03
DAV: 9 -0.367440989412E+03 -0.49643E-04 -0.58755E-06 19284 0.662E-03 0.243E-03
DAV: 10 -0.367441006280E+03 -0.16869E-04 -0.20279E-06 21180 0.395E-03 0.129E-03
DAV: 11 -0.367441024904E+03 -0.18623E-04 -0.31220E-06 19956 0.445E-03 0.155E-03
DAV: 12 -0.367441028837E+03 -0.39335E-05 -0.76581E-07 21876 0.234E-03
116 F= -.36744103E+03 E0= -.36744489E+03 d E =-.752251E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367487694276E+03 -0.46669E-01 -0.26187E+01 25536 0.164E+01 0.194E+00
DAV: 2 -0.367468987042E+03 0.18707E-01 -0.60432E-01 26262 0.244E+00 0.973E-01
DAV: 3 -0.367449791747E+03 0.19195E-01 -0.59301E-02 29658 0.899E-01 0.439E-01
DAV: 4 -0.367447833935E+03 0.19578E-02 -0.14543E-02 31296 0.403E-01 0.190E-01
DAV: 5 -0.367448136719E+03 -0.30278E-03 -0.20209E-03 27888 0.156E-01 0.881E-02
DAV: 6 -0.367448515374E+03 -0.37865E-03 -0.33641E-04 28782 0.752E-02 0.321E-02
DAV: 7 -0.367448851154E+03 -0.33578E-03 -0.83482E-05 28800 0.287E-02 0.128E-02
DAV: 8 -0.367449053361E+03 -0.20221E-03 -0.26103E-05 25992 0.167E-02 0.722E-03
DAV: 9 -0.367449293904E+03 -0.24054E-03 -0.28186E-05 23742 0.133E-02 0.501E-03
DAV: 10 -0.367449418443E+03 -0.12454E-03 -0.12909E-05 21900 0.928E-03 0.267E-03
DAV: 11 -0.367449493071E+03 -0.74628E-04 -0.11631E-05 21486 0.756E-03 0.280E-03
DAV: 12 -0.367449513343E+03 -0.20272E-04 -0.19348E-06 21540 0.411E-03 0.140E-03
DAV: 13 -0.367449533569E+03 -0.20226E-04 -0.33991E-06 19908 0.444E-03 0.147E-03
DAV: 14 -0.367449539020E+03 -0.54509E-05 -0.86747E-07 21516 0.273E-03
117 F= -.36744954E+03 E0= -.36745340E+03 d E =-.160327E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367466010510E+03 -0.16477E-01 -0.43793E+00 25536 0.672E+00 0.791E-01
DAV: 2 -0.367462586315E+03 0.34242E-02 -0.10127E-01 26400 0.996E-01 0.395E-01
DAV: 3 -0.367459171826E+03 0.34145E-02 -0.99724E-03 29544 0.367E-01 0.176E-01
DAV: 4 -0.367458827088E+03 0.34474E-03 -0.25786E-03 31488 0.168E-01 0.763E-02
DAV: 5 -0.367458887416E+03 -0.60328E-04 -0.30724E-04 27876 0.620E-02 0.358E-02
DAV: 6 -0.367458978557E+03 -0.91140E-04 -0.56907E-05 28296 0.301E-02 0.130E-02
DAV: 7 -0.367459054719E+03 -0.76163E-04 -0.10965E-05 19914 0.113E-02 0.489E-03
DAV: 8 -0.367459110957E+03 -0.56238E-04 -0.61751E-06 20166 0.694E-03 0.300E-03
DAV: 9 -0.367459170818E+03 -0.59861E-04 -0.55475E-06 19860 0.579E-03 0.194E-03
DAV: 10 -0.367459204218E+03 -0.33400E-04 -0.36969E-06 20580 0.423E-03 0.124E-03
DAV: 11 -0.367459226399E+03 -0.22181E-04 -0.29664E-06 20364 0.370E-03 0.108E-03
DAV: 12 -0.367459232665E+03 -0.62662E-05 -0.95520E-07 21612 0.213E-03
118 F= -.36745923E+03 E0= -.36746310E+03 d E =-.969365E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367494443984E+03 -0.35218E-01 -0.17546E+01 25536 0.135E+01 0.161E+00
DAV: 2 -0.367480400446E+03 0.14044E-01 -0.41552E-01 26364 0.202E+00 0.792E-01
DAV: 3 -0.367466918562E+03 0.13482E-01 -0.39994E-02 29586 0.740E-01 0.359E-01
DAV: 4 -0.367465566240E+03 0.13523E-02 -0.10603E-02 31356 0.340E-01 0.157E-01
DAV: 5 -0.367465763816E+03 -0.19758E-03 -0.12574E-03 27936 0.126E-01 0.738E-02
DAV: 6 -0.367466060188E+03 -0.29637E-03 -0.23213E-04 28560 0.611E-02 0.265E-02
DAV: 7 -0.367466312085E+03 -0.25190E-03 -0.52567E-05 28956 0.230E-02 0.104E-02
DAV: 8 -0.367466483320E+03 -0.17124E-03 -0.19218E-05 23370 0.133E-02 0.607E-03
DAV: 9 -0.367466664745E+03 -0.18142E-03 -0.19215E-05 23262 0.105E-02 0.396E-03
DAV: 10 -0.367466773406E+03 -0.10866E-03 -0.11744E-05 21846 0.831E-03 0.234E-03
DAV: 11 -0.367466836012E+03 -0.62606E-04 -0.84265E-06 21612 0.611E-03 0.220E-03
DAV: 12 -0.367466856531E+03 -0.20519E-04 -0.17904E-06 21348 0.373E-03 0.101E-03
DAV: 13 -0.367466875339E+03 -0.18809E-04 -0.27152E-06 20310 0.349E-03 0.120E-03
DAV: 14 -0.367466880725E+03 -0.53862E-05 -0.83195E-07 21396 0.272E-03
119 F= -.36746688E+03 E0= -.36747075E+03 d E =-.173417E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367481384784E+03 -0.14509E-01 -0.39283E+00 25536 0.635E+00 0.741E-01
DAV: 2 -0.367478455501E+03 0.29293E-02 -0.90094E-02 26196 0.942E-01 0.373E-01
DAV: 3 -0.367475497423E+03 0.29581E-02 -0.88238E-03 29532 0.347E-01 0.166E-01
DAV: 4 -0.367475196387E+03 0.30104E-03 -0.23474E-03 31488 0.161E-01 0.720E-02
DAV: 5 -0.367475251453E+03 -0.55067E-04 -0.28407E-04 27918 0.596E-02 0.350E-02
DAV: 6 -0.367475330875E+03 -0.79422E-04 -0.53661E-05 28182 0.287E-02 0.127E-02
DAV: 7 -0.367475394831E+03 -0.63956E-04 -0.95032E-06 19992 0.112E-02 0.445E-03
DAV: 8 -0.367475438975E+03 -0.44145E-04 -0.52663E-06 20316 0.660E-03 0.289E-03
DAV: 9 -0.367475486022E+03 -0.47046E-04 -0.40667E-06 19572 0.521E-03 0.170E-03
DAV: 10 -0.367475515673E+03 -0.29651E-04 -0.32439E-06 20460 0.379E-03 0.113E-03
DAV: 11 -0.367475532996E+03 -0.17323E-04 -0.22091E-06 20538 0.318E-03 0.827E-04
DAV: 12 -0.367475538224E+03 -0.52285E-05 -0.74429E-07 21528 0.180E-03
120 F= -.36747554E+03 E0= -.36747940E+03 d E =-.865750E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367503429169E+03 -0.27896E-01 -0.14109E+01 25536 0.120E+01 0.142E+00
DAV: 2 -0.367492632418E+03 0.10797E-01 -0.32959E-01 26148 0.180E+00 0.706E-01
DAV: 3 -0.367482085095E+03 0.10547E-01 -0.31588E-02 29538 0.659E-01 0.317E-01
DAV: 4 -0.367481019846E+03 0.10652E-02 -0.85540E-03 31356 0.307E-01 0.140E-01
DAV: 5 -0.367481196943E+03 -0.17710E-03 -0.10394E-03 27930 0.115E-01 0.671E-02
DAV: 6 -0.367481450426E+03 -0.25348E-03 -0.19802E-04 28608 0.551E-02 0.241E-02
DAV: 7 -0.367481659187E+03 -0.20876E-03 -0.40869E-05 26160 0.214E-02 0.862E-03
DAV: 8 -0.367481791926E+03 -0.13274E-03 -0.14720E-05 21936 0.118E-02 0.534E-03
DAV: 9 -0.367481932833E+03 -0.14091E-03 -0.15671E-05 21534 0.962E-03 0.342E-03
DAV: 10 -0.367482013504E+03 -0.80671E-04 -0.83407E-06 21840 0.702E-03 0.196E-03
DAV: 11 -0.367482059287E+03 -0.45783E-04 -0.51981E-06 20232 0.507E-03 0.165E-03
DAV: 12 -0.367482073920E+03 -0.14633E-04 -0.17713E-06 21192 0.306E-03 0.794E-04
DAV: 13 -0.367482086843E+03 -0.12923E-04 -0.18528E-06 20178 0.289E-03 0.900E-04
DAV: 14 -0.367482090867E+03 -0.40236E-05 -0.72594E-07 21252 0.229E-03
121 F= -.36748209E+03 E0= -.36748596E+03 d E =-.152101E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367497751353E+03 -0.15665E-01 -0.39140E+00 25536 0.634E+00 0.753E-01
DAV: 2 -0.367494072644E+03 0.36787E-02 -0.87146E-02 26388 0.935E-01 0.378E-01
DAV: 3 -0.367490957223E+03 0.31154E-02 -0.95069E-03 29562 0.355E-01 0.164E-01
DAV: 4 -0.367490661834E+03 0.29539E-03 -0.22180E-03 31476 0.160E-01 0.724E-02
DAV: 5 -0.367490718478E+03 -0.56645E-04 -0.29669E-04 27708 0.596E-02 0.346E-02
DAV: 6 -0.367490796123E+03 -0.77645E-04 -0.48950E-05 28410 0.277E-02 0.126E-02
DAV: 7 -0.367490859980E+03 -0.63857E-04 -0.96279E-06 20016 0.110E-02 0.452E-03
DAV: 8 -0.367490904835E+03 -0.44855E-04 -0.50754E-06 20238 0.696E-03 0.275E-03
DAV: 9 -0.367490956801E+03 -0.51965E-04 -0.49568E-06 19644 0.613E-03 0.190E-03
DAV: 10 -0.367490982401E+03 -0.25601E-04 -0.29473E-06 20652 0.427E-03 0.113E-03
DAV: 11 -0.367491001373E+03 -0.18971E-04 -0.25176E-06 20250 0.366E-03 0.990E-04
DAV: 12 -0.367491006389E+03 -0.50160E-05 -0.81518E-07 21660 0.209E-03
122 F= -.36749101E+03 E0= -.36749487E+03 d E =-.891552E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367537121190E+03 -0.46120E-01 -0.21428E+01 25536 0.148E+01 0.179E+00
DAV: 2 -0.367516408707E+03 0.20712E-01 -0.49026E-01 26154 0.222E+00 0.884E-01
DAV: 3 -0.367499620168E+03 0.16789E-01 -0.51618E-02 29538 0.832E-01 0.391E-01
DAV: 4 -0.367498047414E+03 0.15728E-02 -0.12454E-02 31248 0.378E-01 0.175E-01
DAV: 5 -0.367498296968E+03 -0.24955E-03 -0.16260E-03 27774 0.141E-01 0.831E-02
DAV: 6 -0.367498652145E+03 -0.35518E-03 -0.27554E-04 28638 0.656E-02 0.298E-02
DAV: 7 -0.367498945687E+03 -0.29354E-03 -0.63883E-05 28926 0.258E-02 0.112E-02
DAV: 8 -0.367499132990E+03 -0.18730E-03 -0.22804E-05 24066 0.155E-02 0.642E-03
DAV: 9 -0.367499336131E+03 -0.20314E-03 -0.22462E-05 24018 0.126E-02 0.426E-03
DAV: 10 -0.367499453086E+03 -0.11695E-03 -0.13564E-05 21750 0.101E-02 0.244E-03
DAV: 11 -0.367499513978E+03 -0.60892E-04 -0.85566E-06 21738 0.671E-03 0.217E-03
DAV: 12 -0.367499534650E+03 -0.20672E-04 -0.20043E-06 20952 0.409E-03 0.103E-03
DAV: 13 -0.367499551731E+03 -0.17082E-04 -0.23427E-06 20154 0.326E-03 0.104E-03
DAV: 14 -0.367499557411E+03 -0.56795E-05 -0.76770E-07 21264 0.239E-03
123 F= -.36749956E+03 E0= -.36750342E+03 d E =-.174665E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367520852806E+03 -0.21301E-01 -0.68317E+00 25536 0.836E+00 0.998E-01
DAV: 2 -0.367514964360E+03 0.58884E-02 -0.15868E-01 26436 0.124E+00 0.486E-01
DAV: 3 -0.367509512478E+03 0.54519E-02 -0.16101E-02 29556 0.457E-01 0.210E-01
DAV: 4 -0.367509006668E+03 0.50581E-03 -0.37870E-03 31464 0.206E-01 0.951E-02
DAV: 5 -0.367509107304E+03 -0.10064E-03 -0.48391E-04 27810 0.759E-02 0.457E-02
DAV: 6 -0.367509238697E+03 -0.13139E-03 -0.86182E-05 28362 0.387E-02 0.169E-02
DAV: 7 -0.367509349635E+03 -0.11094E-03 -0.21022E-05 21258 0.154E-02 0.657E-03
DAV: 8 -0.367509422628E+03 -0.72993E-04 -0.81770E-06 20292 0.975E-03 0.396E-03
DAV: 9 -0.367509514574E+03 -0.91946E-04 -0.11997E-05 20694 0.896E-03 0.343E-03
DAV: 10 -0.367509549927E+03 -0.35353E-04 -0.34439E-06 20976 0.587E-03 0.170E-03
DAV: 11 -0.367509586223E+03 -0.36296E-04 -0.60287E-06 21096 0.578E-03 0.206E-03
DAV: 12 -0.367509594175E+03 -0.79526E-05 -0.91482E-07 21756 0.308E-03
124 F= -.36750959E+03 E0= -.36751346E+03 d E =-.100368E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367527293057E+03 -0.17707E-01 -0.82720E+00 25536 0.920E+00 0.110E+00
DAV: 2 -0.367520012206E+03 0.72809E-02 -0.19294E-01 26076 0.137E+00 0.535E-01
DAV: 3 -0.367513407131E+03 0.66051E-02 -0.19627E-02 29532 0.506E-01 0.233E-01
DAV: 4 -0.367512789797E+03 0.61733E-03 -0.46280E-03 31440 0.228E-01 0.105E-01
DAV: 5 -0.367512908075E+03 -0.11828E-03 -0.59715E-04 27870 0.842E-02 0.509E-02
DAV: 6 -0.367513064603E+03 -0.15653E-03 -0.10586E-04 28350 0.429E-02 0.188E-02
DAV: 7 -0.367513197348E+03 -0.13274E-03 -0.27083E-05 24942 0.171E-02 0.745E-03
DAV: 8 -0.367513280399E+03 -0.83051E-04 -0.90448E-06 20424 0.106E-02 0.434E-03
DAV: 9 -0.367513387512E+03 -0.10711E-03 -0.14157E-05 20550 0.959E-03 0.380E-03
DAV: 10 -0.367513432299E+03 -0.44787E-04 -0.43150E-06 20892 0.656E-03 0.186E-03
DAV: 11 -0.367513475299E+03 -0.43000E-04 -0.70934E-06 21204 0.628E-03 0.230E-03
DAV: 12 -0.367513485562E+03 -0.10262E-04 -0.11521E-06 21744 0.353E-03 0.104E-03
DAV: 13 -0.367513499032E+03 -0.13471E-04 -0.22159E-06 19956 0.363E-03 0.144E-03
DAV: 14 -0.367513502296E+03 -0.32635E-05 -0.49210E-07 21396 0.217E-03
125 F= -.36751350E+03 E0= -.36751737E+03 d E =-.139449E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367536644660E+03 -0.23146E-01 -0.73707E+00 25536 0.867E+00 0.105E+00
DAV: 2 -0.367529428625E+03 0.72160E-02 -0.16831E-01 26316 0.129E+00 0.521E-01
DAV: 3 -0.367523482181E+03 0.59464E-02 -0.18581E-02 29556 0.492E-01 0.224E-01
DAV: 4 -0.367522898811E+03 0.58337E-03 -0.39124E-03 31452 0.215E-01 0.986E-02
DAV: 5 -0.367523003546E+03 -0.10473E-03 -0.61191E-04 27852 0.837E-02 0.472E-02
DAV: 6 -0.367523144130E+03 -0.14058E-03 -0.10345E-04 28506 0.424E-02 0.179E-02
DAV: 7 -0.367523261995E+03 -0.11787E-03 -0.24489E-05 21216 0.174E-02 0.676E-03
DAV: 8 -0.367523331212E+03 -0.69217E-04 -0.84630E-06 20376 0.983E-03 0.403E-03
DAV: 9 -0.367523417487E+03 -0.86275E-04 -0.11436E-05 20256 0.857E-03 0.322E-03
DAV: 10 -0.367523453798E+03 -0.36311E-04 -0.35736E-06 20772 0.554E-03 0.160E-03
DAV: 11 -0.367523483393E+03 -0.29595E-04 -0.49321E-06 19824 0.533E-03 0.191E-03
DAV: 12 -0.367523488981E+03 -0.55879E-05 -0.90633E-07 21996 0.294E-03
126 F= -.36752349E+03 E0= -.36752735E+03 d E =-.998668E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367532719254E+03 -0.92359E-02 -0.40945E+00 25536 0.646E+00 0.779E-01
DAV: 2 -0.367528640752E+03 0.40785E-02 -0.92953E-02 25854 0.963E-01 0.389E-01
DAV: 3 -0.367525314686E+03 0.33261E-02 -0.10448E-02 29520 0.369E-01 0.166E-01
DAV: 4 -0.367524992070E+03 0.32262E-03 -0.21582E-03 31452 0.160E-01 0.731E-02
DAV: 5 -0.367525053053E+03 -0.60983E-04 -0.34510E-04 27768 0.629E-02 0.349E-02
DAV: 6 -0.367525132017E+03 -0.78964E-04 -0.57125E-05 28608 0.319E-02 0.134E-02
DAV: 7 -0.367525199780E+03 -0.67763E-04 -0.13332E-05 20004 0.131E-02 0.514E-03
DAV: 8 -0.367525240824E+03 -0.41044E-04 -0.55306E-06 20388 0.757E-03 0.317E-03
DAV: 9 -0.367525294271E+03 -0.53447E-04 -0.61056E-06 19164 0.685E-03 0.250E-03
DAV: 10 -0.367525317021E+03 -0.22750E-04 -0.26827E-06 20796 0.428E-03 0.138E-03
DAV: 11 -0.367525336880E+03 -0.19859E-04 -0.32382E-06 19866 0.458E-03 0.148E-03
DAV: 12 -0.367525340984E+03 -0.41038E-05 -0.79784E-07 21888 0.238E-03
127 F= -.36752534E+03 E0= -.36752921E+03 d E =-.118387E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367549550674E+03 -0.24214E-01 -0.67618E+00 25536 0.827E+00 0.105E+00
DAV: 2 -0.367539916499E+03 0.96342E-02 -0.15554E-01 26268 0.125E+00 0.511E-01
DAV: 3 -0.367533923557E+03 0.59929E-02 -0.18597E-02 29544 0.490E-01 0.219E-01
DAV: 4 -0.367533402691E+03 0.52087E-03 -0.39738E-03 31392 0.210E-01 0.100E-01
DAV: 5 -0.367533506323E+03 -0.10363E-03 -0.53442E-04 27810 0.810E-02 0.463E-02
DAV: 6 -0.367533655397E+03 -0.14907E-03 -0.94734E-05 28386 0.401E-02 0.162E-02
DAV: 7 -0.367533770760E+03 -0.11536E-03 -0.22373E-05 22746 0.152E-02 0.652E-03
DAV: 8 -0.367533846208E+03 -0.75448E-04 -0.72096E-06 20244 0.851E-03 0.376E-03
DAV: 9 -0.367533937182E+03 -0.90974E-04 -0.11656E-05 20544 0.792E-03 0.298E-03
DAV: 10 -0.367533974176E+03 -0.36994E-04 -0.36154E-06 20796 0.543E-03 0.150E-03
DAV: 11 -0.367534003852E+03 -0.29676E-04 -0.50183E-06 21066 0.504E-03 0.198E-03
DAV: 12 -0.367534009948E+03 -0.60962E-05 -0.78863E-07 21900 0.289E-03
128 F= -.36753401E+03 E0= -.36753788E+03 d E =-.866896E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367553046802E+03 -0.19043E-01 -0.71696E+00 25536 0.852E+00 0.109E+00
DAV: 2 -0.367542693228E+03 0.10354E-01 -0.16528E-01 26112 0.129E+00 0.527E-01
DAV: 3 -0.367536317532E+03 0.63757E-02 -0.19828E-02 29532 0.506E-01 0.225E-01
DAV: 4 -0.367535768516E+03 0.54902E-03 -0.42242E-03 31368 0.217E-01 0.104E-01
DAV: 5 -0.367535875907E+03 -0.10739E-03 -0.56960E-04 27786 0.840E-02 0.477E-02
DAV: 6 -0.367536031807E+03 -0.15590E-03 -0.10156E-04 28374 0.414E-02 0.167E-02
DAV: 7 -0.367536152129E+03 -0.12032E-03 -0.23660E-05 22788 0.156E-02 0.673E-03
DAV: 8 -0.367536232138E+03 -0.80009E-04 -0.76359E-06 20208 0.880E-03 0.388E-03
DAV: 9 -0.367536327368E+03 -0.95230E-04 -0.12338E-05 20532 0.817E-03 0.305E-03
DAV: 10 -0.367536365173E+03 -0.37804E-04 -0.36507E-06 20880 0.542E-03 0.161E-03
DAV: 11 -0.367536396965E+03 -0.31792E-04 -0.54932E-06 21264 0.533E-03 0.205E-03
DAV: 12 -0.367536403443E+03 -0.64783E-05 -0.79237E-07 21888 0.293E-03
129 F= -.36753640E+03 E0= -.36754027E+03 d E =-.110625E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367557248339E+03 -0.20851E-01 -0.52776E+00 25536 0.734E+00 0.943E-01
DAV: 2 -0.367549301852E+03 0.79465E-02 -0.12607E-01 26136 0.112E+00 0.445E-01
DAV: 3 -0.367544542163E+03 0.47597E-02 -0.14067E-02 29544 0.425E-01 0.192E-01
DAV: 4 -0.367544110394E+03 0.43177E-03 -0.34347E-03 31428 0.190E-01 0.884E-02
DAV: 5 -0.367544193898E+03 -0.83503E-04 -0.40898E-04 27774 0.739E-02 0.425E-02
DAV: 6 -0.367544309315E+03 -0.11542E-03 -0.80577E-05 28482 0.369E-02 0.149E-02
DAV: 7 -0.367544401782E+03 -0.92467E-04 -0.17222E-05 21708 0.139E-02 0.571E-03
DAV: 8 -0.367544464604E+03 -0.62823E-04 -0.66855E-06 20244 0.817E-03 0.354E-03
DAV: 9 -0.367544545616E+03 -0.81011E-04 -0.10083E-05 20676 0.791E-03 0.273E-03
DAV: 10 -0.367544578140E+03 -0.32524E-04 -0.31533E-06 20820 0.514E-03 0.154E-03
DAV: 11 -0.367544605668E+03 -0.27529E-04 -0.42136E-06 20046 0.504E-03 0.180E-03
DAV: 12 -0.367544612181E+03 -0.65127E-05 -0.96154E-07 21744 0.286E-03
130 F= -.36754461E+03 E0= -.36754848E+03 d E =-.820874E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367581651475E+03 -0.37046E-01 -0.13385E+01 25536 0.117E+01 0.152E+00
DAV: 2 -0.367561257505E+03 0.20394E-01 -0.32557E-01 26238 0.180E+00 0.710E-01
DAV: 3 -0.367549242981E+03 0.12015E-01 -0.35549E-02 29526 0.680E-01 0.310E-01
DAV: 4 -0.367548146923E+03 0.10961E-02 -0.89222E-03 31296 0.306E-01 0.144E-01
DAV: 5 -0.367548339951E+03 -0.19303E-03 -0.10772E-03 27804 0.119E-01 0.693E-02
DAV: 6 -0.367548605246E+03 -0.26529E-03 -0.21134E-04 28446 0.596E-02 0.241E-02
DAV: 7 -0.367548825846E+03 -0.22060E-03 -0.50148E-05 27444 0.225E-02 0.943E-03
DAV: 8 -0.367548958284E+03 -0.13244E-03 -0.14673E-05 21684 0.129E-02 0.568E-03
DAV: 9 -0.367549120096E+03 -0.16181E-03 -0.20324E-05 22266 0.114E-02 0.430E-03
DAV: 10 -0.367549192298E+03 -0.72202E-04 -0.72554E-06 21840 0.806E-03 0.230E-03
DAV: 11 -0.367549249068E+03 -0.56770E-04 -0.84431E-06 21228 0.717E-03 0.268E-03
DAV: 12 -0.367549263663E+03 -0.14595E-04 -0.15785E-06 21732 0.420E-03 0.121E-03
DAV: 13 -0.367549280874E+03 -0.17211E-04 -0.28376E-06 19836 0.425E-03 0.174E-03
DAV: 14 -0.367549285641E+03 -0.47666E-05 -0.76630E-07 21252 0.277E-03
131 F= -.36754929E+03 E0= -.36755315E+03 d E =-.128822E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367571627391E+03 -0.22347E-01 -0.53685E+00 25536 0.747E+00 0.983E-01
DAV: 2 -0.367562412183E+03 0.92152E-02 -0.12980E-01 26646 0.116E+00 0.474E-01
DAV: 3 -0.367557361560E+03 0.50506E-02 -0.16002E-02 29574 0.456E-01 0.204E-01
DAV: 4 -0.367556856131E+03 0.50543E-03 -0.36267E-03 31404 0.203E-01 0.913E-02
DAV: 5 -0.367556933899E+03 -0.77768E-04 -0.49688E-04 27768 0.778E-02 0.442E-02
DAV: 6 -0.367557053862E+03 -0.11996E-03 -0.85969E-05 28422 0.371E-02 0.160E-02
DAV: 7 -0.367557151005E+03 -0.97143E-04 -0.16606E-05 20604 0.143E-02 0.573E-03
DAV: 8 -0.367557216045E+03 -0.65040E-04 -0.76876E-06 20100 0.886E-03 0.353E-03
DAV: 9 -0.367557291919E+03 -0.75874E-04 -0.90065E-06 20550 0.749E-03 0.265E-03
DAV: 10 -0.367557326247E+03 -0.34328E-04 -0.33072E-06 20676 0.519E-03 0.142E-03
DAV: 11 -0.367557353740E+03 -0.27493E-04 -0.40517E-06 20472 0.455E-03 0.158E-03
DAV: 12 -0.367557359638E+03 -0.58980E-05 -0.79234E-07 21864 0.260E-03
132 F= -.36755736E+03 E0= -.36756123E+03 d E =-.807400E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367562841963E+03 -0.54882E-02 -0.16083E+00 25548 0.408E+00 0.537E-01
DAV: 2 -0.367560040727E+03 0.28012E-02 -0.38458E-02 25968 0.633E-01 0.260E-01
DAV: 3 -0.367558519021E+03 0.15217E-02 -0.48736E-03 29514 0.251E-01 0.111E-01
DAV: 4 -0.367558366144E+03 0.15288E-03 -0.10716E-03 31404 0.111E-01 0.495E-02
DAV: 5 -0.367558386944E+03 -0.20800E-04 -0.14983E-04 28206 0.426E-02 0.239E-02
DAV: 6 -0.367558423990E+03 -0.37045E-04 -0.23240E-05 21498 0.202E-02 0.877E-03
DAV: 7 -0.367558458315E+03 -0.34326E-04 -0.69359E-06 20052 0.902E-03 0.342E-03
DAV: 8 -0.367558479503E+03 -0.21188E-04 -0.23001E-06 20376 0.517E-03 0.206E-03
DAV: 9 -0.367558511317E+03 -0.31814E-04 -0.37692E-06 19380 0.539E-03 0.210E-03
DAV: 10 -0.367558520707E+03 -0.93901E-05 -0.11004E-06 21252 0.325E-03
133 F= -.36755852E+03 E0= -.36756239E+03 d E =-.923507E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367573175912E+03 -0.14665E-01 -0.28476E+00 25536 0.548E+00 0.737E-01
DAV: 2 -0.367567995451E+03 0.51805E-02 -0.72308E-02 26352 0.870E-01 0.341E-01
DAV: 3 -0.367565267115E+03 0.27283E-02 -0.88684E-03 29682 0.336E-01 0.147E-01
DAV: 4 -0.367565001118E+03 0.26600E-03 -0.19347E-03 31440 0.150E-01 0.676E-02
DAV: 5 -0.367565043977E+03 -0.42858E-04 -0.26550E-04 27720 0.554E-02 0.331E-02
DAV: 6 -0.367565116603E+03 -0.72626E-04 -0.48015E-05 28440 0.283E-02 0.120E-02
DAV: 7 -0.367565176711E+03 -0.60109E-04 -0.95090E-06 20124 0.108E-02 0.467E-03
DAV: 8 -0.367565220916E+03 -0.44205E-04 -0.52407E-06 20058 0.728E-03 0.286E-03
DAV: 9 -0.367565270161E+03 -0.49245E-04 -0.44534E-06 19788 0.566E-03 0.217E-03
DAV: 10 -0.367565298522E+03 -0.28360E-04 -0.29088E-06 20496 0.431E-03 0.116E-03
DAV: 11 -0.367565321375E+03 -0.22853E-04 -0.30362E-06 20280 0.394E-03 0.128E-03
DAV: 12 -0.367565326826E+03 -0.54513E-05 -0.83815E-07 21720 0.236E-03
134 F= -.36756533E+03 E0= -.36756919E+03 d E =-.680612E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367579250757E+03 -0.13929E-01 -0.40064E+00 25536 0.650E+00 0.877E-01
DAV: 2 -0.367571907245E+03 0.73435E-02 -0.10219E-01 26730 0.104E+00 0.405E-01
DAV: 3 -0.367568072402E+03 0.38348E-02 -0.12558E-02 29706 0.401E-01 0.175E-01
DAV: 4 -0.367567695903E+03 0.37650E-03 -0.27309E-03 31452 0.178E-01 0.806E-02
DAV: 5 -0.367567751088E+03 -0.55185E-04 -0.37816E-04 27726 0.661E-02 0.394E-02
DAV: 6 -0.367567846473E+03 -0.95384E-04 -0.68142E-05 28452 0.338E-02 0.143E-02
DAV: 7 -0.367567924154E+03 -0.77682E-04 -0.13527E-05 20076 0.129E-02 0.556E-03
DAV: 8 -0.367567980098E+03 -0.55944E-04 -0.72056E-06 20118 0.863E-03 0.338E-03
DAV: 9 -0.367568042040E+03 -0.61942E-04 -0.60304E-06 19782 0.672E-03 0.258E-03
DAV: 10 -0.367568076587E+03 -0.34547E-04 -0.36920E-06 20472 0.495E-03 0.139E-03
DAV: 11 -0.367568106003E+03 -0.29416E-04 -0.41891E-06 20208 0.473E-03 0.154E-03
DAV: 12 -0.367568112620E+03 -0.66171E-05 -0.10903E-06 21744 0.276E-03
135 F= -.36756811E+03 E0= -.36757198E+03 d E =-.959191E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367583325112E+03 -0.15219E-01 -0.36111E+00 25536 0.617E+00 0.808E-01
DAV: 2 -0.367577235338E+03 0.60898E-02 -0.91533E-02 26556 0.986E-01 0.375E-01
DAV: 3 -0.367573888227E+03 0.33471E-02 -0.10898E-02 29538 0.372E-01 0.161E-01
DAV: 4 -0.367573574561E+03 0.31367E-03 -0.25152E-03 31392 0.171E-01 0.742E-02
DAV: 5 -0.367573617877E+03 -0.43316E-04 -0.32431E-04 27648 0.630E-02 0.381E-02
DAV: 6 -0.367573696424E+03 -0.78546E-04 -0.64142E-05 28434 0.329E-02 0.141E-02
DAV: 7 -0.367573762960E+03 -0.66537E-04 -0.12421E-05 19932 0.129E-02 0.536E-03
DAV: 8 -0.367573808723E+03 -0.45763E-04 -0.66234E-06 20208 0.867E-03 0.340E-03
DAV: 9 -0.367573862511E+03 -0.53788E-04 -0.54274E-06 19584 0.700E-03 0.270E-03
DAV: 10 -0.367573892420E+03 -0.29908E-04 -0.32648E-06 20532 0.530E-03 0.139E-03
DAV: 11 -0.367573920357E+03 -0.27938E-04 -0.39033E-06 20130 0.487E-03 0.167E-03
DAV: 12 -0.367573926465E+03 -0.61076E-05 -0.99029E-07 21744 0.278E-03
136 F= -.36757393E+03 E0= -.36757779E+03 d E =-.581385E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367576718905E+03 -0.27985E-02 -0.80758E-01 25584 0.292E+00 0.381E-01
DAV: 2 -0.367575338208E+03 0.13807E-02 -0.20224E-02 25800 0.465E-01 0.178E-01
DAV: 3 -0.367574584040E+03 0.75417E-03 -0.24718E-03 29376 0.176E-01 0.756E-02
DAV: 4 -0.367574510233E+03 0.73807E-04 -0.55496E-04 31380 0.805E-02 0.348E-02
DAV: 5 -0.367574518733E+03 -0.85006E-05 -0.70790E-05 28368 0.295E-02
137 F= -.36757452E+03 E0= -.36757838E+03 d E =-.640611E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367585297928E+03 -0.10788E-01 -0.19484E+00 25536 0.452E+00 0.596E-01
DAV: 2 -0.367581297491E+03 0.40004E-02 -0.47026E-02 25710 0.715E-01 0.290E-01
DAV: 3 -0.367579232824E+03 0.20647E-02 -0.66940E-03 29568 0.286E-01 0.120E-01
DAV: 4 -0.367579086929E+03 0.14590E-03 -0.13379E-03 30696 0.129E-01 0.548E-02
DAV: 5 -0.367579140069E+03 -0.53140E-04 -0.18823E-04 27612 0.483E-02 0.273E-02
DAV: 6 -0.367579215997E+03 -0.75928E-04 -0.35625E-05 25884 0.244E-02 0.103E-02
DAV: 7 -0.367579277756E+03 -0.61759E-04 -0.86541E-06 20124 0.107E-02 0.419E-03
DAV: 8 -0.367579321330E+03 -0.43574E-04 -0.49069E-06 20130 0.722E-03 0.266E-03
DAV: 9 -0.367579375265E+03 -0.53935E-04 -0.53459E-06 19470 0.683E-03 0.223E-03
DAV: 10 -0.367579399255E+03 -0.23990E-04 -0.30339E-06 20700 0.494E-03 0.120E-03
DAV: 11 -0.367579418965E+03 -0.19710E-04 -0.26643E-06 20064 0.419E-03 0.118E-03
DAV: 12 -0.367579423985E+03 -0.50193E-05 -0.89858E-07 21588 0.251E-03
138 F= -.36757942E+03 E0= -.36758329E+03 d E =-.490525E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367584134810E+03 -0.47158E-02 -0.11760E+00 25548 0.351E+00 0.462E-01
DAV: 2 -0.367581791737E+03 0.23431E-02 -0.28343E-02 26508 0.555E-01 0.225E-01
DAV: 3 -0.367580559921E+03 0.12318E-02 -0.40687E-03 29598 0.224E-01 0.925E-02
DAV: 4 -0.367580453304E+03 0.10662E-03 -0.79359E-04 31404 0.996E-02 0.422E-02
DAV: 5 -0.367580465327E+03 -0.12023E-04 -0.11742E-04 28050 0.377E-02 0.210E-02
DAV: 6 -0.367580493547E+03 -0.28220E-04 -0.19653E-05 20112 0.189E-02 0.798E-03
DAV: 7 -0.367580520366E+03 -0.26820E-04 -0.56995E-06 19908 0.883E-03 0.319E-03
DAV: 8 -0.367580538650E+03 -0.18284E-04 -0.22080E-06 20232 0.538E-03 0.195E-03
DAV: 9 -0.367580565240E+03 -0.26590E-04 -0.31515E-06 19548 0.568E-03 0.216E-03
DAV: 10 -0.367580571535E+03 -0.62942E-05 -0.91580E-07 21576 0.323E-03
139 F= -.36758057E+03 E0= -.36758444E+03 d E =-.605280E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367592561716E+03 -0.11996E-01 -0.26000E+00 25560 0.520E+00 0.662E-01
DAV: 2 -0.367588293372E+03 0.42683E-02 -0.61829E-02 26202 0.799E-01 0.317E-01
DAV: 3 -0.367585697074E+03 0.25963E-02 -0.78518E-03 29526 0.305E-01 0.125E-01
DAV: 4 -0.367585524478E+03 0.17260E-03 -0.16144E-03 31416 0.135E-01 0.589E-02
DAV: 5 -0.367585562108E+03 -0.37631E-04 -0.17285E-04 27702 0.475E-02 0.294E-02
DAV: 6 -0.367585626929E+03 -0.64821E-04 -0.37309E-05 27048 0.244E-02 0.107E-02
DAV: 7 -0.367585679374E+03 -0.52445E-04 -0.73382E-06 19998 0.957E-03 0.412E-03
DAV: 8 -0.367585721352E+03 -0.41978E-04 -0.48918E-06 19944 0.666E-03 0.275E-03
DAV: 9 -0.367585764612E+03 -0.43260E-04 -0.33653E-06 19896 0.509E-03 0.166E-03
DAV: 10 -0.367585797953E+03 -0.33342E-04 -0.38961E-06 20148 0.471E-03 0.116E-03
DAV: 11 -0.367585812461E+03 -0.14508E-04 -0.16687E-06 20784 0.287E-03 0.853E-04
DAV: 12 -0.367585819630E+03 -0.71691E-05 -0.88129E-07 20292 0.207E-03
140 F= -.36758582E+03 E0= -.36758969E+03 d E =-.524810E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367589770435E+03 -0.39580E-02 -0.11298E+00 25548 0.342E+00 0.436E-01
DAV: 2 -0.367587901684E+03 0.18688E-02 -0.26723E-02 26610 0.526E-01 0.209E-01
DAV: 3 -0.367586769326E+03 0.11324E-02 -0.34525E-03 29490 0.202E-01 0.822E-02
DAV: 4 -0.367586689341E+03 0.79985E-04 -0.69480E-04 31392 0.887E-02 0.387E-02
DAV: 5 -0.367586702604E+03 -0.13262E-04 -0.75181E-05 28176 0.312E-02 0.193E-02
DAV: 6 -0.367586730229E+03 -0.27625E-04 -0.14783E-05 20028 0.161E-02 0.696E-03
DAV: 7 -0.367586754863E+03 -0.24635E-04 -0.41365E-06 20106 0.704E-03 0.284E-03
DAV: 8 -0.367586773461E+03 -0.18597E-04 -0.18593E-06 20112 0.449E-03 0.181E-03
DAV: 9 -0.367586797443E+03 -0.23982E-04 -0.22146E-06 19884 0.413E-03 0.155E-03
DAV: 10 -0.367586808599E+03 -0.11156E-04 -0.11371E-06 20748 0.313E-03 0.758E-04
DAV: 11 -0.367586818718E+03 -0.10119E-04 -0.11177E-06 20106 0.254E-03 0.818E-04
DAV: 12 -0.367586821628E+03 -0.29104E-05 -0.37579E-07 21252 0.161E-03
141 F= -.36758682E+03 E0= -.36759069E+03 d E =-.625009E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367598773444E+03 -0.11955E-01 -0.31207E+00 25536 0.570E+00 0.683E-01
DAV: 2 -0.367595048909E+03 0.37245E-02 -0.71020E-02 26718 0.854E-01 0.340E-01
DAV: 3 -0.367592267933E+03 0.27810E-02 -0.86187E-03 29538 0.314E-01 0.132E-01
DAV: 4 -0.367592089057E+03 0.17888E-03 -0.15942E-03 31404 0.136E-01 0.587E-02
DAV: 5 -0.367592127712E+03 -0.38655E-04 -0.19088E-04 27654 0.472E-02 0.296E-02
DAV: 6 -0.367592188924E+03 -0.61213E-04 -0.38719E-05 25806 0.253E-02 0.116E-02
DAV: 7 -0.367592239237E+03 -0.50313E-04 -0.93366E-06 19896 0.110E-02 0.441E-03
DAV: 8 -0.367592271841E+03 -0.32604E-04 -0.44127E-06 20148 0.676E-03 0.275E-03
DAV: 9 -0.367592312139E+03 -0.40299E-04 -0.37229E-06 19374 0.528E-03 0.199E-03
DAV: 10 -0.367592336750E+03 -0.24610E-04 -0.26416E-06 20292 0.403E-03 0.103E-03
DAV: 11 -0.367592353461E+03 -0.16711E-04 -0.20810E-06 20214 0.333E-03 0.114E-03
DAV: 12 -0.367592358517E+03 -0.50561E-05 -0.68256E-07 21156 0.220E-03
142 F= -.36759236E+03 E0= -.36759622E+03 d E =-.553689E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367596206196E+03 -0.38527E-02 -0.13565E+00 25536 0.376E+00 0.449E-01
DAV: 2 -0.367594565479E+03 0.16407E-02 -0.30687E-02 26316 0.562E-01 0.224E-01
DAV: 3 -0.367593350927E+03 0.12146E-02 -0.37944E-03 29472 0.208E-01 0.864E-02
DAV: 4 -0.367593271633E+03 0.79294E-04 -0.68639E-04 31332 0.897E-02 0.386E-02
DAV: 5 -0.367593287303E+03 -0.15671E-04 -0.83482E-05 27714 0.312E-02 0.194E-02
DAV: 6 -0.367593315173E+03 -0.27870E-04 -0.15604E-05 20532 0.166E-02 0.758E-03
DAV: 7 -0.367593340096E+03 -0.24923E-04 -0.49119E-06 19932 0.787E-03 0.305E-03
DAV: 8 -0.367593355374E+03 -0.15278E-04 -0.17714E-06 20268 0.453E-03 0.188E-03
DAV: 9 -0.367593378481E+03 -0.23106E-04 -0.25068E-06 19488 0.447E-03 0.184E-03
DAV: 10 -0.367593387287E+03 -0.88062E-05 -0.91095E-07 20844 0.298E-03
143 F= -.36759339E+03 E0= -.36759725E+03 d E =-.656566E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367602157482E+03 -0.87790E-02 -0.18988E+00 25536 0.446E+00 0.538E-01
DAV: 2 -0.367599749684E+03 0.24078E-02 -0.43235E-02 25962 0.664E-01 0.265E-01
DAV: 3 -0.367598015343E+03 0.17343E-02 -0.52795E-03 29466 0.246E-01 0.104E-01
DAV: 4 -0.367597906632E+03 0.10871E-03 -0.99915E-04 32208 0.108E-01 0.470E-02
DAV: 5 -0.367597933160E+03 -0.26528E-04 -0.11151E-04 27636 0.363E-02 0.232E-02
DAV: 6 -0.367597974695E+03 -0.41535E-04 -0.20825E-05 20652 0.193E-02 0.870E-03
DAV: 7 -0.367598010889E+03 -0.36194E-04 -0.64514E-06 19908 0.862E-03 0.353E-03
DAV: 8 -0.367598035589E+03 -0.24700E-04 -0.26624E-06 20244 0.543E-03 0.210E-03
DAV: 9 -0.367598068495E+03 -0.32906E-04 -0.34548E-06 19566 0.503E-03 0.207E-03
DAV: 10 -0.367598080242E+03 -0.11747E-04 -0.12312E-06 21012 0.338E-03 0.959E-04
DAV: 11 -0.367598096942E+03 -0.16700E-04 -0.22764E-06 19644 0.361E-03 0.117E-03
DAV: 12 -0.367598100297E+03 -0.33546E-05 -0.57582E-07 21600 0.214E-03
144 F= -.36759810E+03 E0= -.36760197E+03 d E =-.471301E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367614982375E+03 -0.16885E-01 -0.62624E+00 25536 0.810E+00 0.985E-01
DAV: 2 -0.367606975015E+03 0.80074E-02 -0.14468E-01 26712 0.122E+00 0.481E-01
DAV: 3 -0.367601281011E+03 0.56940E-02 -0.17364E-02 29514 0.448E-01 0.192E-01
DAV: 4 -0.367600920720E+03 0.36029E-03 -0.33742E-03 31884 0.198E-01 0.868E-02
DAV: 5 -0.367601006580E+03 -0.85860E-04 -0.37781E-04 27582 0.669E-02 0.429E-02
DAV: 6 -0.367601127305E+03 -0.12073E-03 -0.77381E-05 28536 0.355E-02 0.162E-02
DAV: 7 -0.367601222463E+03 -0.95158E-04 -0.16213E-05 20010 0.139E-02 0.609E-03
DAV: 8 -0.367601290799E+03 -0.68337E-04 -0.95373E-06 19974 0.956E-03 0.376E-03
DAV: 9 -0.367601361529E+03 -0.70729E-04 -0.64885E-06 19722 0.689E-03 0.258E-03
DAV: 10 -0.367601408614E+03 -0.47086E-04 -0.58083E-06 20652 0.568E-03 0.142E-03
DAV: 11 -0.367601438346E+03 -0.29732E-04 -0.37405E-06 20346 0.417E-03 0.136E-03
DAV: 12 -0.367601447415E+03 -0.90682E-05 -0.12517E-06 21180 0.286E-03
145 F= -.36760145E+03 E0= -.36760531E+03 d E =-.806013E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367614164185E+03 -0.12726E-01 -0.32289E+00 25536 0.582E+00 0.696E-01
DAV: 2 -0.367610524317E+03 0.36399E-02 -0.75102E-02 26538 0.876E-01 0.337E-01
DAV: 3 -0.367607796292E+03 0.27280E-02 -0.85130E-03 29502 0.315E-01 0.135E-01
DAV: 4 -0.367607607029E+03 0.18926E-03 -0.17410E-03 31344 0.142E-01 0.611E-02
DAV: 5 -0.367607645152E+03 -0.38123E-04 -0.20119E-04 27696 0.496E-02 0.312E-02
DAV: 6 -0.367607703063E+03 -0.57911E-04 -0.40133E-05 26796 0.262E-02 0.120E-02
DAV: 7 -0.367607754286E+03 -0.51223E-04 -0.84997E-06 19962 0.103E-02 0.443E-03
DAV: 8 -0.367607791476E+03 -0.37190E-04 -0.47718E-06 20148 0.724E-03 0.265E-03
DAV: 9 -0.367607832290E+03 -0.40815E-04 -0.33950E-06 19830 0.541E-03 0.200E-03
DAV: 10 -0.367607860705E+03 -0.28414E-04 -0.30489E-06 20244 0.474E-03 0.106E-03
DAV: 11 -0.367607880267E+03 -0.19562E-04 -0.23820E-06 20310 0.350E-03 0.107E-03
DAV: 12 -0.367607886021E+03 -0.57537E-05 -0.80692E-07 21132 0.236E-03
146 F= -.36760789E+03 E0= -.36761175E+03 d E =-.643861E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367626542998E+03 -0.18663E-01 -0.76558E+00 25536 0.896E+00 0.108E+00
DAV: 2 -0.367617808237E+03 0.87348E-02 -0.18021E-01 26754 0.136E+00 0.519E-01
DAV: 3 -0.367611345658E+03 0.64626E-02 -0.20042E-02 29538 0.487E-01 0.211E-01
DAV: 4 -0.367610899680E+03 0.44598E-03 -0.42481E-03 31236 0.221E-01 0.953E-02
DAV: 5 -0.367610993521E+03 -0.93841E-04 -0.46115E-04 27600 0.758E-02 0.485E-02
DAV: 6 -0.367611126240E+03 -0.13272E-03 -0.96280E-05 28470 0.401E-02 0.181E-02
DAV: 7 -0.367611233068E+03 -0.10683E-03 -0.19262E-05 21294 0.153E-02 0.664E-03
DAV: 8 -0.367611309448E+03 -0.76380E-04 -0.98411E-06 19980 0.107E-02 0.395E-03
DAV: 9 -0.367611387130E+03 -0.77682E-04 -0.78789E-06 21078 0.773E-03 0.281E-03
DAV: 10 -0.367611446935E+03 -0.59805E-04 -0.64447E-06 20124 0.724E-03 0.160E-03
DAV: 11 -0.367611479112E+03 -0.32177E-04 -0.48823E-06 21858 0.462E-03 0.146E-03
DAV: 12 -0.367611490120E+03 -0.11007E-04 -0.10524E-06 20928 0.305E-03 0.726E-04
DAV: 13 -0.367611499813E+03 -0.96932E-05 -0.12455E-06 19674 0.221E-03
147 F= -.36761150E+03 E0= -.36761537E+03 d E =-.100524E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367625747335E+03 -0.14257E-01 -0.44529E+00 25536 0.687E+00 0.815E-01
DAV: 2 -0.367621151683E+03 0.45957E-02 -0.10442E-01 26958 0.104E+00 0.407E-01
DAV: 3 -0.367617544699E+03 0.36070E-02 -0.11547E-02 29730 0.378E-01 0.167E-01
DAV: 4 -0.367617255391E+03 0.28931E-03 -0.24626E-03 31248 0.171E-01 0.719E-02
DAV: 5 -0.367617301101E+03 -0.45710E-04 -0.31896E-04 27558 0.625E-02 0.362E-02
DAV: 6 -0.367617371272E+03 -0.70171E-04 -0.58425E-05 28482 0.307E-02 0.146E-02
DAV: 7 -0.367617434968E+03 -0.63697E-04 -0.12019E-05 21024 0.124E-02 0.507E-03
DAV: 8 -0.367617476288E+03 -0.41320E-04 -0.52618E-06 20172 0.752E-03 0.302E-03
DAV: 9 -0.367617525776E+03 -0.49488E-04 -0.44206E-06 19356 0.620E-03 0.223E-03
DAV: 10 -0.367617556631E+03 -0.30855E-04 -0.31673E-06 20316 0.450E-03 0.126E-03
DAV: 11 -0.367617583327E+03 -0.26696E-04 -0.34728E-06 19950 0.426E-03 0.131E-03
DAV: 12 -0.367617589267E+03 -0.59404E-05 -0.92166E-07 21624 0.261E-03
148 F= -.36761759E+03 E0= -.36762146E+03 d E =-.608945E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367624874655E+03 -0.72913E-02 -0.32565E+00 25536 0.588E+00 0.697E-01
DAV: 2 -0.367621447537E+03 0.34271E-02 -0.76025E-02 26532 0.886E-01 0.349E-01
DAV: 3 -0.367618792074E+03 0.26555E-02 -0.85273E-03 29502 0.325E-01 0.143E-01
DAV: 4 -0.367618579126E+03 0.21295E-03 -0.18040E-03 31200 0.146E-01 0.617E-02
DAV: 5 -0.367618611515E+03 -0.32389E-04 -0.23603E-04 27552 0.538E-02 0.310E-02
DAV: 6 -0.367618664380E+03 -0.52864E-04 -0.42949E-05 27012 0.261E-02 0.126E-02
DAV: 7 -0.367618714154E+03 -0.49774E-04 -0.85122E-06 19680 0.106E-02 0.424E-03
DAV: 8 -0.367618747684E+03 -0.33530E-04 -0.41159E-06 20160 0.659E-03 0.258E-03
DAV: 9 -0.367618787297E+03 -0.39613E-04 -0.32498E-06 19464 0.528E-03 0.187E-03
DAV: 10 -0.367618812053E+03 -0.24757E-04 -0.24803E-06 20316 0.401E-03 0.109E-03
DAV: 11 -0.367618832220E+03 -0.20166E-04 -0.23682E-06 19932 0.343E-03 0.103E-03
DAV: 12 -0.367618837410E+03 -0.51899E-05 -0.71515E-07 21252 0.217E-03
149 F= -.36761884E+03 E0= -.36762270E+03 d E =-.733760E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367631785596E+03 -0.12953E-01 -0.41755E+00 25536 0.664E+00 0.792E-01
DAV: 2 -0.367627697137E+03 0.40885E-02 -0.10125E-01 26694 0.101E+00 0.387E-01
DAV: 3 -0.367624193780E+03 0.35034E-02 -0.10518E-02 29562 0.362E-01 0.161E-01
DAV: 4 -0.367623915397E+03 0.27838E-03 -0.25122E-03 31236 0.168E-01 0.722E-02
DAV: 5 -0.367623958649E+03 -0.43251E-04 -0.26572E-04 29046 0.583E-02 0.363E-02
DAV: 6 -0.367624029557E+03 -0.70908E-04 -0.55046E-05 28356 0.298E-02 0.135E-02
DAV: 7 -0.367624091959E+03 -0.62403E-04 -0.98558E-06 19836 0.113E-02 0.485E-03
DAV: 8 -0.367624140495E+03 -0.48535E-04 -0.66085E-06 19902 0.806E-03 0.323E-03
DAV: 9 -0.367624186052E+03 -0.45557E-04 -0.33623E-06 19806 0.569E-03 0.200E-03
DAV: 10 -0.367624229616E+03 -0.43564E-04 -0.51290E-06 19842 0.562E-03 0.139E-03
DAV: 11 -0.367624250209E+03 -0.20593E-04 -0.25138E-06 20520 0.342E-03 0.108E-03
DAV: 12 -0.367624258468E+03 -0.82591E-05 -0.10120E-06 20544 0.244E-03
150 F= -.36762426E+03 E0= -.36762812E+03 d E =-.542106E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367635528207E+03 -0.11278E-01 -0.52781E+00 25536 0.747E+00 0.893E-01
DAV: 2 -0.367630318553E+03 0.52097E-02 -0.12864E-01 26706 0.114E+00 0.436E-01
DAV: 3 -0.367625880050E+03 0.44385E-02 -0.13295E-02 29562 0.407E-01 0.182E-01
DAV: 4 -0.367625526167E+03 0.35388E-03 -0.32088E-03 31212 0.190E-01 0.816E-02
DAV: 5 -0.367625581964E+03 -0.55797E-04 -0.34583E-04 28944 0.663E-02 0.412E-02
DAV: 6 -0.367625669170E+03 -0.87206E-04 -0.70886E-05 28410 0.339E-02 0.155E-02
DAV: 7 -0.367625745968E+03 -0.76798E-04 -0.12958E-05 19830 0.129E-02 0.550E-03
DAV: 8 -0.367625804160E+03 -0.58193E-04 -0.83298E-06 19890 0.911E-03 0.363E-03
DAV: 9 -0.367625859750E+03 -0.55590E-04 -0.43482E-06 19842 0.644E-03 0.229E-03
DAV: 10 -0.367625911312E+03 -0.51562E-04 -0.63271E-06 19836 0.632E-03 0.153E-03
DAV: 11 -0.367625936335E+03 -0.25023E-04 -0.32167E-06 20568 0.392E-03 0.125E-03
DAV: 12 -0.367625945765E+03 -0.94300E-05 -0.12172E-06 20580 0.276E-03
151 F= -.36762595E+03 E0= -.36762981E+03 d E =-.710836E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367636582252E+03 -0.10646E-01 -0.32014E+00 25536 0.579E+00 0.667E-01
DAV: 2 -0.367633975084E+03 0.26072E-02 -0.74759E-02 26454 0.870E-01 0.332E-01
DAV: 3 -0.367631394358E+03 0.25807E-02 -0.74644E-03 29508 0.305E-01 0.139E-01
DAV: 4 -0.367631180871E+03 0.21349E-03 -0.18687E-03 31296 0.145E-01 0.606E-02
DAV: 5 -0.367631209495E+03 -0.28625E-04 -0.18176E-04 29178 0.485E-02 0.307E-02
DAV: 6 -0.367631261579E+03 -0.52084E-04 -0.40198E-05 27576 0.254E-02 0.114E-02
DAV: 7 -0.367631307306E+03 -0.45727E-04 -0.71859E-06 20010 0.979E-03 0.420E-03
DAV: 8 -0.367631344330E+03 -0.37024E-04 -0.49427E-06 19788 0.689E-03 0.280E-03
DAV: 9 -0.367631379384E+03 -0.35055E-04 -0.24643E-06 20010 0.481E-03 0.172E-03
DAV: 10 -0.367631413709E+03 -0.34325E-04 -0.36679E-06 19800 0.471E-03 0.116E-03
DAV: 11 -0.367631431183E+03 -0.17474E-04 -0.20081E-06 20544 0.292E-03 0.902E-04
DAV: 12 -0.367631437682E+03 -0.64992E-05 -0.74213E-07 20418 0.203E-03
152 F= -.36763144E+03 E0= -.36763530E+03 d E =-.549192E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367645358387E+03 -0.13927E-01 -0.67905E+00 25536 0.843E+00 0.978E-01
DAV: 2 -0.367639742526E+03 0.56159E-02 -0.16022E-01 26670 0.127E+00 0.484E-01
DAV: 3 -0.367634274566E+03 0.54680E-02 -0.15750E-02 29556 0.446E-01 0.204E-01
DAV: 4 -0.367633824760E+03 0.44981E-03 -0.40707E-03 31296 0.213E-01 0.895E-02
DAV: 5 -0.367633889405E+03 -0.64645E-04 -0.39030E-04 29094 0.713E-02 0.455E-02
DAV: 6 -0.367633993756E+03 -0.10435E-03 -0.87901E-05 28386 0.372E-02 0.167E-02
DAV: 7 -0.367634080790E+03 -0.87034E-04 -0.15475E-05 21468 0.141E-02 0.604E-03
DAV: 8 -0.367634149310E+03 -0.68521E-04 -0.90281E-06 19782 0.974E-03 0.388E-03
DAV: 9 -0.367634212155E+03 -0.62845E-04 -0.52555E-06 20046 0.662E-03 0.242E-03
DAV: 10 -0.367634275506E+03 -0.63351E-04 -0.77983E-06 19890 0.709E-03 0.174E-03
DAV: 11 -0.367634302134E+03 -0.26628E-04 -0.32634E-06 20724 0.396E-03 0.121E-03
DAV: 12 -0.367634313671E+03 -0.11537E-04 -0.15080E-06 20250 0.281E-03 0.610E-04
DAV: 13 -0.367634322236E+03 -0.85652E-05 -0.13227E-06 19674 0.208E-03
153 F= -.36763432E+03 E0= -.36763819E+03 d E =-.837647E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367647566827E+03 -0.13253E-01 -0.39309E+00 25536 0.642E+00 0.752E-01
DAV: 2 -0.367643622022E+03 0.39448E-02 -0.90191E-02 26862 0.961E-01 0.387E-01
DAV: 3 -0.367640297385E+03 0.33246E-02 -0.10218E-02 30840 0.356E-01 0.160E-01
DAV: 4 -0.367639998734E+03 0.29865E-03 -0.20969E-03 31248 0.161E-01 0.665E-02
DAV: 5 -0.367640031816E+03 -0.33082E-04 -0.28056E-04 28998 0.572E-02 0.334E-02
DAV: 6 -0.367640094377E+03 -0.62561E-04 -0.55253E-05 28176 0.294E-02 0.133E-02
DAV: 7 -0.367640148118E+03 -0.53741E-04 -0.10621E-05 20058 0.125E-02 0.497E-03
DAV: 8 -0.367640188008E+03 -0.39890E-04 -0.63099E-06 19866 0.827E-03 0.311E-03
DAV: 9 -0.367640230179E+03 -0.42172E-04 -0.35162E-06 19710 0.596E-03 0.211E-03
DAV: 10 -0.367640260246E+03 -0.30067E-04 -0.31258E-06 20112 0.471E-03 0.117E-03
DAV: 11 -0.367640283206E+03 -0.22960E-04 -0.28087E-06 19998 0.383E-03 0.109E-03
DAV: 12 -0.367640289383E+03 -0.61771E-05 -0.83390E-07 21156 0.241E-03
154 F= -.36764029E+03 E0= -.36764416E+03 d E =-.596715E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367646416706E+03 -0.61335E-02 -0.26051E+00 25536 0.523E+00 0.612E-01
DAV: 2 -0.367643753771E+03 0.26629E-02 -0.59546E-02 26514 0.783E-01 0.316E-01
DAV: 3 -0.367641538909E+03 0.22149E-02 -0.68485E-03 30798 0.291E-01 0.129E-01
DAV: 4 -0.367641340679E+03 0.19823E-03 -0.13792E-03 31224 0.131E-01 0.541E-02
DAV: 5 -0.367641360771E+03 -0.20092E-04 -0.18795E-04 29004 0.469E-02 0.271E-02
DAV: 6 -0.367641404003E+03 -0.43232E-04 -0.35913E-05 25674 0.239E-02 0.108E-02
DAV: 7 -0.367641442573E+03 -0.38570E-04 -0.76961E-06 19944 0.105E-02 0.411E-03
DAV: 8 -0.367641470515E+03 -0.27942E-04 -0.41134E-06 19992 0.678E-03 0.255E-03
DAV: 9 -0.367641503027E+03 -0.32512E-04 -0.27989E-06 19662 0.530E-03 0.191E-03
DAV: 10 -0.367641522597E+03 -0.19570E-04 -0.19203E-06 20280 0.385E-03 0.100E-03
DAV: 11 -0.367641540794E+03 -0.18197E-04 -0.21409E-06 19770 0.347E-03 0.995E-04
DAV: 12 -0.367641545297E+03 -0.45031E-05 -0.63143E-07 21192 0.212E-03
155 F= -.36764155E+03 E0= -.36764541E+03 d E =-.722306E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367656554204E+03 -0.15013E-01 -0.44316E+00 25536 0.678E+00 0.816E-01
DAV: 2 -0.367651453342E+03 0.51009E-02 -0.10381E-01 26772 0.101E+00 0.405E-01
DAV: 3 -0.367647585006E+03 0.38683E-02 -0.12070E-02 29532 0.379E-01 0.162E-01
DAV: 4 -0.367647292846E+03 0.29216E-03 -0.23362E-03 31224 0.169E-01 0.724E-02
DAV: 5 -0.367647331039E+03 -0.38192E-04 -0.28988E-04 28992 0.595E-02 0.355E-02
DAV: 6 -0.367647407705E+03 -0.76666E-04 -0.57653E-05 28302 0.310E-02 0.137E-02
DAV: 7 -0.367647474516E+03 -0.66811E-04 -0.11796E-05 19968 0.127E-02 0.538E-03
DAV: 8 -0.367647527680E+03 -0.53164E-04 -0.76547E-06 19764 0.920E-03 0.341E-03
DAV: 9 -0.367647584168E+03 -0.56487E-04 -0.49709E-06 19782 0.730E-03 0.245E-03
DAV: 10 -0.367647624313E+03 -0.40146E-04 -0.50036E-06 20124 0.627E-03 0.131E-03
DAV: 11 -0.367647647758E+03 -0.23444E-04 -0.30282E-06 20376 0.416E-03 0.121E-03
DAV: 12 -0.367647656571E+03 -0.88135E-05 -0.11979E-06 20424 0.283E-03
156 F= -.36764766E+03 E0= -.36765152E+03 d E =-.611127E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367662933776E+03 -0.15286E-01 -0.62371E+00 25536 0.805E+00 0.973E-01
DAV: 2 -0.367655692606E+03 0.72412E-02 -0.14728E-01 26694 0.121E+00 0.480E-01
DAV: 3 -0.367650239282E+03 0.54533E-02 -0.16936E-02 29538 0.450E-01 0.194E-01
DAV: 4 -0.367649823300E+03 0.41598E-03 -0.33457E-03 31188 0.202E-01 0.865E-02
DAV: 5 -0.367649878546E+03 -0.55246E-04 -0.41041E-04 28932 0.708E-02 0.425E-02
DAV: 6 -0.367649982952E+03 -0.10441E-03 -0.81949E-05 28356 0.371E-02 0.163E-02
DAV: 7 -0.367650072638E+03 -0.89686E-04 -0.17747E-05 21882 0.152E-02 0.642E-03
DAV: 8 -0.367650142050E+03 -0.69413E-04 -0.89228E-06 19836 0.106E-02 0.381E-03
DAV: 9 -0.367650217450E+03 -0.75400E-04 -0.79637E-06 20754 0.843E-03 0.291E-03
DAV: 10 -0.367650273287E+03 -0.55837E-04 -0.66966E-06 20064 0.794E-03 0.151E-03
DAV: 11 -0.367650300383E+03 -0.27096E-04 -0.37918E-06 20496 0.460E-03 0.140E-03
DAV: 12 -0.367650311197E+03 -0.10815E-04 -0.13559E-06 20364 0.314E-03 0.608E-04
DAV: 13 -0.367650320286E+03 -0.90888E-05 -0.14517E-06 19254 0.234E-03
157 F= -.36765032E+03 E0= -.36765419E+03 d E =-.877499E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367668525461E+03 -0.18214E-01 -0.58469E+00 25536 0.781E+00 0.902E-01
DAV: 2 -0.367663158222E+03 0.53672E-02 -0.13292E-01 26868 0.115E+00 0.457E-01
DAV: 3 -0.367658460700E+03 0.46975E-02 -0.15198E-02 29550 0.421E-01 0.182E-01
DAV: 4 -0.367658124844E+03 0.33586E-03 -0.27180E-03 31224 0.185E-01 0.810E-02
DAV: 5 -0.367658173093E+03 -0.48249E-04 -0.37574E-04 28932 0.665E-02 0.401E-02
DAV: 6 -0.367658258594E+03 -0.85501E-04 -0.70239E-05 28380 0.343E-02 0.161E-02
DAV: 7 -0.367658337457E+03 -0.78863E-04 -0.15837E-05 19788 0.144E-02 0.597E-03
DAV: 8 -0.367658393640E+03 -0.56183E-04 -0.82520E-06 19974 0.957E-03 0.356E-03
DAV: 9 -0.367658463065E+03 -0.69425E-04 -0.69062E-06 19458 0.807E-03 0.294E-03
DAV: 10 -0.367658502196E+03 -0.39131E-04 -0.46506E-06 20316 0.601E-03 0.147E-03
DAV: 11 -0.367658535841E+03 -0.33645E-04 -0.46257E-06 19866 0.507E-03 0.150E-03
DAV: 12 -0.367658544755E+03 -0.89145E-05 -0.14009E-06 21204 0.306E-03
158 F= -.36765854E+03 E0= -.36766241E+03 d E =-.822447E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367676711535E+03 -0.18176E-01 -0.88204E+00 25536 0.959E+00 0.111E+00
DAV: 2 -0.367668409083E+03 0.83025E-02 -0.20190E-01 26478 0.142E+00 0.563E-01
DAV: 3 -0.367661318335E+03 0.70907E-02 -0.22962E-02 29544 0.520E-01 0.225E-01
DAV: 4 -0.367660810595E+03 0.50774E-03 -0.41625E-03 31152 0.229E-01 0.100E-01
DAV: 5 -0.367660886188E+03 -0.75592E-04 -0.57920E-04 27876 0.829E-02 0.493E-02
DAV: 6 -0.367661009748E+03 -0.12356E-03 -0.10571E-04 28482 0.425E-02 0.197E-02
DAV: 7 -0.367661122726E+03 -0.11298E-03 -0.26932E-05 23604 0.179E-02 0.751E-03
DAV: 8 -0.367661196900E+03 -0.74175E-04 -0.90219E-06 20052 0.109E-02 0.410E-03
DAV: 9 -0.367661298339E+03 -0.10144E-03 -0.12700E-05 20460 0.992E-03 0.382E-03
DAV: 10 -0.367661354334E+03 -0.55995E-04 -0.61474E-06 20304 0.813E-03 0.164E-03
DAV: 11 -0.367661396890E+03 -0.42556E-04 -0.67454E-06 21348 0.589E-03 0.206E-03
DAV: 12 -0.367661409253E+03 -0.12363E-04 -0.13538E-06 21096 0.379E-03 0.851E-04
DAV: 13 -0.367661422324E+03 -0.13071E-04 -0.20433E-06 19014 0.317E-03 0.129E-03
DAV: 14 -0.367661425159E+03 -0.28353E-05 -0.47994E-07 20964 0.193E-03
159 F= -.36766143E+03 E0= -.36766529E+03 d E =-.111049E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367676865529E+03 -0.15443E-01 -0.54456E+00 25536 0.754E+00 0.867E-01
DAV: 2 -0.367671872882E+03 0.49926E-02 -0.12153E-01 27072 0.110E+00 0.448E-01
DAV: 3 -0.367667490370E+03 0.43825E-02 -0.14062E-02 29568 0.409E-01 0.180E-01
DAV: 4 -0.367667174518E+03 0.31585E-03 -0.25090E-03 31188 0.180E-01 0.804E-02
DAV: 5 -0.367667218812E+03 -0.44294E-04 -0.38347E-04 27606 0.668E-02 0.391E-02
DAV: 6 -0.367667295309E+03 -0.76497E-04 -0.67069E-05 28362 0.333E-02 0.158E-02
DAV: 7 -0.367667366967E+03 -0.71658E-04 -0.14716E-05 19740 0.137E-02 0.560E-03
DAV: 8 -0.367667416615E+03 -0.49648E-04 -0.68637E-06 19968 0.882E-03 0.320E-03
DAV: 9 -0.367667477919E+03 -0.61304E-04 -0.59526E-06 19506 0.725E-03 0.266E-03
DAV: 10 -0.367667510660E+03 -0.32741E-04 -0.37088E-06 20388 0.534E-03 0.135E-03
DAV: 11 -0.367667541611E+03 -0.30951E-04 -0.41279E-06 19680 0.476E-03 0.136E-03
DAV: 12 -0.367667548874E+03 -0.72629E-05 -0.11985E-06 21300 0.284E-03
160 F= -.36766755E+03 E0= -.36767141E+03 d E =-.612371E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367705274815E+03 -0.37733E-01 -0.19166E+01 25536 0.142E+01 0.165E+00
DAV: 2 -0.367687353354E+03 0.17921E-01 -0.44091E-01 26502 0.209E+00 0.842E-01
DAV: 3 -0.367672097895E+03 0.15255E-01 -0.48724E-02 29550 0.769E-01 0.347E-01
DAV: 4 -0.367670974633E+03 0.11233E-02 -0.92925E-03 30972 0.343E-01 0.155E-01
DAV: 5 -0.367671137944E+03 -0.16331E-03 -0.13158E-03 27492 0.125E-01 0.750E-02
DAV: 6 -0.367671382448E+03 -0.24450E-03 -0.23785E-04 28524 0.623E-02 0.293E-02
DAV: 7 -0.367671588049E+03 -0.20560E-03 -0.54948E-05 28896 0.253E-02 0.107E-02
DAV: 8 -0.367671718587E+03 -0.13054E-03 -0.19451E-05 22668 0.155E-02 0.600E-03
DAV: 9 -0.367671871757E+03 -0.15317E-03 -0.15619E-05 20298 0.119E-02 0.442E-03
DAV: 10 -0.367671981373E+03 -0.10962E-03 -0.14787E-05 22632 0.106E-02 0.249E-03
DAV: 11 -0.367672047606E+03 -0.66232E-04 -0.79416E-06 21504 0.678E-03 0.206E-03
DAV: 12 -0.367672070711E+03 -0.23106E-04 -0.24349E-06 20724 0.434E-03 0.916E-04
DAV: 13 -0.367672086978E+03 -0.16267E-04 -0.22751E-06 19254 0.304E-03 0.105E-03
DAV: 14 -0.367672091986E+03 -0.50079E-05 -0.80770E-07 20556 0.222E-03
161 F= -.36767209E+03 E0= -.36767596E+03 d E =-.106668E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367692010936E+03 -0.19924E-01 -0.67983E+00 25536 0.840E+00 0.971E-01
DAV: 2 -0.367686444535E+03 0.55664E-02 -0.15679E-01 27012 0.124E+00 0.490E-01
DAV: 3 -0.367681008643E+03 0.54359E-02 -0.15950E-02 29562 0.439E-01 0.202E-01
DAV: 4 -0.367680579432E+03 0.42921E-03 -0.34782E-03 31128 0.203E-01 0.885E-02
DAV: 5 -0.367680634027E+03 -0.54595E-04 -0.38798E-04 28950 0.698E-02 0.436E-02
DAV: 6 -0.367680732192E+03 -0.98165E-04 -0.80541E-05 28404 0.365E-02 0.163E-02
DAV: 7 -0.367680818445E+03 -0.86253E-04 -0.16027E-05 21528 0.144E-02 0.614E-03
DAV: 8 -0.367680888136E+03 -0.69691E-04 -0.93539E-06 19698 0.102E-02 0.381E-03
DAV: 9 -0.367680958525E+03 -0.70388E-04 -0.62828E-06 19776 0.746E-03 0.265E-03
DAV: 10 -0.367681020610E+03 -0.62085E-04 -0.85762E-06 20856 0.776E-03 0.168E-03
DAV: 11 -0.367681048051E+03 -0.27442E-04 -0.29648E-06 20472 0.420E-03 0.128E-03
DAV: 12 -0.367681059118E+03 -0.11067E-04 -0.13835E-06 20106 0.284E-03 0.615E-04
DAV: 13 -0.367681068030E+03 -0.89114E-05 -0.12990E-06 19176 0.218E-03
162 F= -.36768107E+03 E0= -.36768493E+03 d E =-.897604E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367728976577E+03 -0.47917E-01 -0.26674E+01 25536 0.166E+01 0.196E+00
DAV: 2 -0.367706955395E+03 0.22021E-01 -0.64172E-01 26904 0.249E+00 0.973E-01
DAV: 3 -0.367685975904E+03 0.20979E-01 -0.61335E-02 29640 0.876E-01 0.415E-01
DAV: 4 -0.367684227405E+03 0.17485E-02 -0.14652E-02 30960 0.411E-01 0.183E-01
DAV: 5 -0.367684451399E+03 -0.22399E-03 -0.15991E-03 28896 0.142E-01 0.898E-02
DAV: 6 -0.367684785810E+03 -0.33441E-03 -0.33082E-04 28554 0.740E-02 0.329E-02
DAV: 7 -0.367685058351E+03 -0.27254E-03 -0.70967E-05 29010 0.290E-02 0.124E-02
DAV: 8 -0.367685247415E+03 -0.18906E-03 -0.31588E-05 25644 0.188E-02 0.784E-03
DAV: 9 -0.367685432449E+03 -0.18503E-03 -0.16871E-05 20808 0.133E-02 0.507E-03
DAV: 10 -0.367685622664E+03 -0.19021E-03 -0.33591E-05 24918 0.153E-02 0.360E-03
DAV: 11 -0.367685695268E+03 -0.72604E-04 -0.83448E-06 21996 0.771E-03 0.228E-03
DAV: 12 -0.367685729475E+03 -0.34207E-04 -0.40844E-06 19986 0.505E-03 0.123E-03
DAV: 13 -0.367685748414E+03 -0.18940E-04 -0.25474E-06 19938 0.312E-03 0.891E-04
DAV: 14 -0.367685756532E+03 -0.81177E-05 -0.13266E-06 19686 0.250E-03
163 F= -.36768576E+03 E0= -.36768962E+03 d E =-.136645E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367688532836E+03 -0.27844E-02 -0.14126E+00 25536 0.383E+00 0.435E-01
DAV: 2 -0.367687386486E+03 0.11463E-02 -0.31237E-02 27876 0.557E-01 0.225E-01
DAV: 3 -0.367686245201E+03 0.11413E-02 -0.35252E-03 29772 0.203E-01 0.884E-02
DAV: 4 -0.367686156452E+03 0.88749E-04 -0.67127E-04 31296 0.907E-02 0.390E-02
DAV: 5 -0.367686153374E+03 0.30777E-05 -0.79503E-05 29856 0.314E-02
164 F= -.36768615E+03 E0= -.36769002E+03 d E =-.140614E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367707277219E+03 -0.21121E-01 -0.79030E+00 25536 0.907E+00 0.103E+00
DAV: 2 -0.367701326979E+03 0.59502E-02 -0.17694E-01 27168 0.133E+00 0.533E-01
DAV: 3 -0.367695169624E+03 0.61574E-02 -0.18130E-02 29370 0.479E-01 0.218E-01
DAV: 4 -0.367694615657E+03 0.55397E-03 -0.41153E-03 31152 0.219E-01 0.913E-02
DAV: 5 -0.367694630652E+03 -0.14994E-04 -0.47142E-04 30486 0.767E-02 0.455E-02
DAV: 6 -0.367694695792E+03 -0.65140E-04 -0.92948E-05 27786 0.386E-02 0.176E-02
DAV: 7 -0.367694758507E+03 -0.62715E-04 -0.16957E-05 21990 0.156E-02 0.613E-03
DAV: 8 -0.367694808770E+03 -0.50262E-04 -0.76045E-06 19470 0.973E-03 0.373E-03
DAV: 9 -0.367694864753E+03 -0.55983E-04 -0.52476E-06 19812 0.723E-03 0.256E-03
DAV: 10 -0.367694910993E+03 -0.46240E-04 -0.53605E-06 19728 0.671E-03 0.153E-03
DAV: 11 -0.367694939724E+03 -0.28731E-04 -0.35898E-06 20160 0.450E-03 0.135E-03
DAV: 12 -0.367694949538E+03 -0.98141E-05 -0.13377E-06 20700 0.305E-03
165 F= -.36769495E+03 E0= -.36769881E+03 d E =-.879616E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367714738277E+03 -0.19799E-01 -0.10173E+01 25536 0.103E+01 0.118E+00
DAV: 2 -0.367706467336E+03 0.82709E-02 -0.22904E-01 26688 0.151E+00 0.606E-01
DAV: 3 -0.367698375809E+03 0.80915E-02 -0.23353E-02 29574 0.544E-01 0.249E-01
DAV: 4 -0.367697699680E+03 0.67613E-03 -0.54027E-03 31104 0.251E-01 0.105E-01
DAV: 5 -0.367697770408E+03 -0.70728E-04 -0.60677E-04 29022 0.876E-02 0.521E-02
DAV: 6 -0.367697898939E+03 -0.12853E-03 -0.12363E-04 28512 0.443E-02 0.200E-02
DAV: 7 -0.367698013850E+03 -0.11491E-03 -0.24384E-05 22500 0.181E-02 0.725E-03
DAV: 8 -0.367698102973E+03 -0.89123E-04 -0.11305E-05 19770 0.118E-02 0.450E-03
DAV: 9 -0.367698203708E+03 -0.10073E-03 -0.11036E-05 20868 0.940E-03 0.327E-03
DAV: 10 -0.367698282608E+03 -0.78900E-04 -0.10309E-05 21348 0.929E-03 0.211E-03
DAV: 11 -0.367698320858E+03 -0.38250E-04 -0.42990E-06 20226 0.529E-03 0.156E-03
DAV: 12 -0.367698335495E+03 -0.14638E-04 -0.20320E-06 20448 0.354E-03 0.768E-04
DAV: 13 -0.367698346105E+03 -0.10609E-04 -0.16067E-06 19104 0.244E-03 0.693E-04
DAV: 14 -0.367698348960E+03 -0.28550E-05 -0.65875E-07 20520 0.183E-03
166 F= -.36769835E+03 E0= -.36770221E+03 d E =-.121956E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367726294218E+03 -0.27948E-01 -0.10019E+01 25536 0.102E+01 0.119E+00
DAV: 2 -0.367716415244E+03 0.98790E-02 -0.22686E-01 27222 0.151E+00 0.609E-01
DAV: 3 -0.367707887117E+03 0.85281E-02 -0.25339E-02 29616 0.562E-01 0.247E-01
DAV: 4 -0.367707257748E+03 0.62937E-03 -0.53861E-03 31104 0.254E-01 0.110E-01
DAV: 5 -0.367707329090E+03 -0.71342E-04 -0.62943E-04 28974 0.890E-02 0.536E-02
DAV: 6 -0.367707458977E+03 -0.12989E-03 -0.12734E-04 28632 0.453E-02 0.202E-02
DAV: 7 -0.367707568979E+03 -0.11000E-03 -0.25789E-05 22482 0.191E-02 0.745E-03
DAV: 8 -0.367707655174E+03 -0.86195E-04 -0.11895E-05 19740 0.124E-02 0.463E-03
DAV: 9 -0.367707750358E+03 -0.95184E-04 -0.10435E-05 20994 0.973E-03 0.321E-03
DAV: 10 -0.367707821148E+03 -0.70790E-04 -0.88463E-06 20664 0.899E-03 0.194E-03
DAV: 11 -0.367707858467E+03 -0.37320E-04 -0.50456E-06 20946 0.547E-03 0.156E-03
DAV: 12 -0.367707873118E+03 -0.14651E-04 -0.17277E-06 20454 0.346E-03 0.721E-04
DAV: 13 -0.367707883681E+03 -0.10563E-04 -0.15323E-06 19128 0.240E-03 0.745E-04
DAV: 14 -0.367707886572E+03 -0.28913E-05 -0.55479E-07 20532 0.180E-03
167 F= -.36770789E+03 E0= -.36771175E+03 d E =-.953761E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367743288416E+03 -0.35405E-01 -0.16983E+01 25536 0.133E+01 0.157E+00
DAV: 2 -0.367726244778E+03 0.17044E-01 -0.39116E-01 27180 0.197E+00 0.795E-01
DAV: 3 -0.367711807987E+03 0.14437E-01 -0.42648E-02 29640 0.732E-01 0.326E-01
DAV: 4 -0.367710723093E+03 0.10849E-02 -0.93858E-03 31020 0.334E-01 0.145E-01
DAV: 5 -0.367710846798E+03 -0.12370E-03 -0.10753E-03 28212 0.117E-01 0.708E-02
DAV: 6 -0.367711052430E+03 -0.20563E-03 -0.21619E-04 28632 0.592E-02 0.263E-02
DAV: 7 -0.367711223845E+03 -0.17142E-03 -0.44580E-05 27744 0.245E-02 0.982E-03
DAV: 8 -0.367711351284E+03 -0.12744E-03 -0.19464E-05 22500 0.155E-02 0.619E-03
DAV: 9 -0.367711489276E+03 -0.13799E-03 -0.13537E-05 20766 0.123E-02 0.409E-03
DAV: 10 -0.367711599725E+03 -0.11045E-03 -0.16231E-05 22926 0.116E-02 0.260E-03
DAV: 11 -0.367711654177E+03 -0.54453E-04 -0.60217E-06 20514 0.668E-03 0.192E-03
DAV: 12 -0.367711680062E+03 -0.25885E-04 -0.40502E-06 20808 0.472E-03 0.896E-04
DAV: 13 -0.367711691839E+03 -0.11777E-04 -0.14427E-06 20028 0.261E-03 0.809E-04
DAV: 14 -0.367711697250E+03 -0.54110E-05 -0.98574E-07 19512 0.224E-03
168 F= -.36771170E+03 E0= -.36771556E+03 d E =-.133483E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367730063699E+03 -0.18372E-01 -0.60432E+00 25536 0.790E+00 0.920E-01
DAV: 2 -0.367724163305E+03 0.59004E-02 -0.13645E-01 27210 0.117E+00 0.467E-01
DAV: 3 -0.367719085685E+03 0.50776E-02 -0.15360E-02 29586 0.432E-01 0.186E-01
DAV: 4 -0.367718719428E+03 0.36626E-03 -0.31598E-03 31128 0.194E-01 0.835E-02
DAV: 5 -0.367718759289E+03 -0.39861E-04 -0.35243E-04 28968 0.668E-02 0.412E-02
DAV: 6 -0.367718845661E+03 -0.86372E-04 -0.75578E-05 28626 0.350E-02 0.156E-02
DAV: 7 -0.367718919404E+03 -0.73743E-04 -0.14936E-05 21672 0.146E-02 0.585E-03
DAV: 8 -0.367718977998E+03 -0.58594E-04 -0.81387E-06 19884 0.962E-03 0.373E-03
DAV: 9 -0.367719044471E+03 -0.66473E-04 -0.57078E-06 19710 0.732E-03 0.247E-03
DAV: 10 -0.367719102798E+03 -0.58327E-04 -0.78823E-06 20994 0.717E-03 0.159E-03
DAV: 11 -0.367719130208E+03 -0.27410E-04 -0.29690E-06 20304 0.410E-03 0.125E-03
DAV: 12 -0.367719141380E+03 -0.11172E-04 -0.14649E-06 19974 0.281E-03 0.577E-04
DAV: 13 -0.367719148456E+03 -0.70755E-05 -0.11209E-06 19320 0.201E-03
169 F= -.36771915E+03 E0= -.36772301E+03 d E =-.745121E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367771033024E+03 -0.51892E-01 -0.25198E+01 25536 0.162E+01 0.192E+00
DAV: 2 -0.367745944753E+03 0.25088E-01 -0.59084E-01 27006 0.242E+00 0.954E-01
DAV: 3 -0.367725179792E+03 0.20765E-01 -0.62470E-02 29652 0.883E-01 0.394E-01
DAV: 4 -0.367723607178E+03 0.15726E-02 -0.13943E-02 30900 0.405E-01 0.177E-01
DAV: 5 -0.367723784224E+03 -0.17705E-03 -0.15263E-03 28908 0.140E-01 0.873E-02
DAV: 6 -0.367724078541E+03 -0.29432E-03 -0.32593E-04 28668 0.728E-02 0.323E-02
DAV: 7 -0.367724318025E+03 -0.23948E-03 -0.68530E-05 29172 0.298E-02 0.121E-02
DAV: 8 -0.367724486877E+03 -0.16885E-03 -0.29462E-05 25218 0.185E-02 0.782E-03
DAV: 9 -0.367724671468E+03 -0.18459E-03 -0.16770E-05 20814 0.135E-02 0.487E-03
DAV: 10 -0.367724857376E+03 -0.18591E-03 -0.31920E-05 24846 0.147E-02 0.348E-03
DAV: 11 -0.367724932083E+03 -0.74707E-04 -0.89930E-06 21792 0.770E-03 0.225E-03
DAV: 12 -0.367724966402E+03 -0.34319E-04 -0.43499E-06 19902 0.506E-03 0.120E-03
DAV: 13 -0.367724981776E+03 -0.15374E-04 -0.23661E-06 19920 0.306E-03 0.866E-04
DAV: 14 -0.367724988201E+03 -0.64246E-05 -0.12243E-06 19638 0.246E-03
170 F= -.36772499E+03 E0= -.36772885E+03 d E =-.132910E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367738980651E+03 -0.13999E-01 -0.37733E+00 25536 0.629E+00 0.717E-01
DAV: 2 -0.367735597766E+03 0.33829E-02 -0.82660E-02 27198 0.924E-01 0.370E-01
DAV: 3 -0.367732597464E+03 0.30003E-02 -0.93650E-03 29568 0.339E-01 0.146E-01
DAV: 4 -0.367732361263E+03 0.23620E-03 -0.18083E-03 31104 0.150E-01 0.620E-02
DAV: 5 -0.367732381902E+03 -0.20639E-04 -0.24312E-04 29124 0.545E-02 0.311E-02
DAV: 6 -0.367732433905E+03 -0.52003E-04 -0.47680E-05 28608 0.274E-02 0.127E-02
DAV: 7 -0.367732482352E+03 -0.48447E-04 -0.91318E-06 19854 0.113E-02 0.454E-03
DAV: 8 -0.367732519393E+03 -0.37041E-04 -0.50657E-06 19968 0.733E-03 0.278E-03
DAV: 9 -0.367732562924E+03 -0.43530E-04 -0.34056E-06 19746 0.568E-03 0.195E-03
DAV: 10 -0.367732596925E+03 -0.34001E-04 -0.36438E-06 19962 0.487E-03 0.117E-03
DAV: 11 -0.367732619186E+03 -0.22261E-04 -0.27415E-06 19872 0.351E-03 0.101E-03
DAV: 12 -0.367732626721E+03 -0.75348E-05 -0.10505E-06 20400 0.251E-03
171 F= -.36773263E+03 E0= -.36773649E+03 d E =-.763852E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367775544348E+03 -0.42925E-01 -0.22093E+01 25536 0.152E+01 0.177E+00
DAV: 2 -0.367755004655E+03 0.20540E-01 -0.50050E-01 26928 0.227E+00 0.894E-01
DAV: 3 -0.367737816973E+03 0.17188E-01 -0.53457E-02 29598 0.817E-01 0.364E-01
DAV: 4 -0.367736466710E+03 0.13503E-02 -0.11156E-02 30924 0.370E-01 0.155E-01
DAV: 5 -0.367736603230E+03 -0.13652E-03 -0.14099E-03 27492 0.133E-01 0.772E-02
DAV: 6 -0.367736854755E+03 -0.25153E-03 -0.28194E-04 28584 0.667E-02 0.307E-02
DAV: 7 -0.367737071605E+03 -0.21685E-03 -0.56610E-05 29064 0.268E-02 0.109E-02
DAV: 8 -0.367737216818E+03 -0.14521E-03 -0.22603E-05 23700 0.160E-02 0.649E-03
DAV: 9 -0.367737379921E+03 -0.16310E-03 -0.14917E-05 20904 0.120E-02 0.431E-03
DAV: 10 -0.367737530587E+03 -0.15067E-03 -0.23296E-05 23874 0.124E-02 0.307E-03
DAV: 11 -0.367737597138E+03 -0.66551E-04 -0.74317E-06 21708 0.673E-03 0.200E-03
DAV: 12 -0.367737629054E+03 -0.31916E-04 -0.41947E-06 19812 0.496E-03 0.131E-03
DAV: 13 -0.367737641105E+03 -0.12051E-04 -0.18890E-06 20196 0.292E-03 0.864E-04
DAV: 14 -0.367737646216E+03 -0.51109E-05 -0.11072E-06 19314 0.255E-03
172 F= -.36773765E+03 E0= -.36774151E+03 d E =-.126580E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367740121849E+03 -0.24807E-02 -0.11367E+00 25536 0.345E+00 0.389E-01
DAV: 2 -0.367739109216E+03 0.10126E-02 -0.24150E-02 27618 0.503E-01 0.204E-01
DAV: 3 -0.367738204119E+03 0.90510E-03 -0.29566E-03 29616 0.188E-01 0.779E-02
DAV: 4 -0.367738132785E+03 0.71334E-04 -0.51975E-04 31176 0.818E-02 0.332E-02
DAV: 5 -0.367738129099E+03 0.36861E-05 -0.73763E-05 29136 0.299E-02
173 F= -.36773813E+03 E0= -.36774199E+03 d E =-.131409E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367755189894E+03 -0.17057E-01 -0.56817E+00 25536 0.774E+00 0.877E-01
DAV: 2 -0.367750811119E+03 0.43788E-02 -0.12677E-01 26874 0.113E+00 0.445E-01
DAV: 3 -0.367746431070E+03 0.43800E-02 -0.13589E-02 29334 0.407E-01 0.179E-01
DAV: 4 -0.367746080865E+03 0.35021E-03 -0.26741E-03 31092 0.183E-01 0.789E-02
DAV: 5 -0.367746085729E+03 -0.48641E-05 -0.33987E-04 31050 0.646E-02 0.383E-02
DAV: 6 -0.367746128176E+03 -0.42447E-04 -0.64729E-05 27864 0.327E-02 0.150E-02
DAV: 7 -0.367746168999E+03 -0.40823E-04 -0.11384E-05 20088 0.130E-02 0.513E-03
DAV: 8 -0.367746201260E+03 -0.32261E-04 -0.58843E-06 19716 0.837E-03 0.307E-03
DAV: 9 -0.367746234399E+03 -0.33139E-04 -0.26669E-06 20016 0.553E-03 0.190E-03
DAV: 10 -0.367746264026E+03 -0.29628E-04 -0.31360E-06 19842 0.474E-03 0.113E-03
DAV: 11 -0.367746283147E+03 -0.19121E-04 -0.21783E-06 19902 0.332E-03 0.955E-04
DAV: 12 -0.367746290372E+03 -0.72253E-05 -0.84393E-07 20358 0.223E-03
174 F= -.36774629E+03 E0= -.36775016E+03 d E =-.816127E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367759451147E+03 -0.13168E-01 -0.63334E+00 25536 0.818E+00 0.930E-01
DAV: 2 -0.367754278197E+03 0.51729E-02 -0.14205E-01 26910 0.120E+00 0.472E-01
DAV: 3 -0.367749274010E+03 0.50042E-02 -0.15182E-02 29568 0.431E-01 0.190E-01
DAV: 4 -0.367748909708E+03 0.36430E-03 -0.30337E-03 31080 0.194E-01 0.840E-02
DAV: 5 -0.367748949689E+03 -0.39981E-04 -0.37974E-04 29052 0.687E-02 0.409E-02
DAV: 6 -0.367749030174E+03 -0.80484E-04 -0.74476E-05 28884 0.350E-02 0.159E-02
DAV: 7 -0.367749101974E+03 -0.71800E-04 -0.13958E-05 19800 0.141E-02 0.564E-03
DAV: 8 -0.367749155734E+03 -0.53760E-04 -0.83105E-06 20010 0.941E-03 0.355E-03
DAV: 9 -0.367749211428E+03 -0.55695E-04 -0.44249E-06 19806 0.673E-03 0.225E-03
DAV: 10 -0.367749259939E+03 -0.48511E-04 -0.57899E-06 20136 0.615E-03 0.143E-03
DAV: 11 -0.367749286524E+03 -0.26585E-04 -0.33841E-06 20082 0.396E-03 0.112E-03
DAV: 12 -0.367749296867E+03 -0.10342E-04 -0.13874E-06 20226 0.276E-03 0.556E-04
DAV: 13 -0.367749303688E+03 -0.68214E-05 -0.12866E-06 18978 0.198E-03
175 F= -.36774930E+03 E0= -.36775317E+03 d E =-.111746E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367762214381E+03 -0.12918E-01 -0.47303E+00 25536 0.706E+00 0.750E-01
DAV: 2 -0.367760104714E+03 0.21097E-02 -0.10161E-01 27060 0.101E+00 0.391E-01
DAV: 3 -0.367756771895E+03 0.33328E-02 -0.98598E-03 29586 0.344E-01 0.159E-01
DAV: 4 -0.367756509522E+03 0.26237E-03 -0.19604E-03 31152 0.154E-01 0.684E-02
DAV: 5 -0.367756535392E+03 -0.25870E-04 -0.23473E-04 29250 0.529E-02 0.326E-02
DAV: 6 -0.367756589650E+03 -0.54258E-04 -0.48723E-05 28794 0.284E-02 0.130E-02
DAV: 7 -0.367756638461E+03 -0.48810E-04 -0.93938E-06 20034 0.119E-02 0.474E-03
DAV: 8 -0.367756677604E+03 -0.39143E-04 -0.60294E-06 19944 0.786E-03 0.312E-03
DAV: 9 -0.367756720392E+03 -0.42788E-04 -0.31107E-06 19872 0.540E-03 0.194E-03
DAV: 10 -0.367756763682E+03 -0.43290E-04 -0.48585E-06 19842 0.493E-03 0.130E-03
DAV: 11 -0.367756785698E+03 -0.22016E-04 -0.27871E-06 20088 0.322E-03 0.957E-04
DAV: 12 -0.367756794668E+03 -0.89705E-05 -0.11678E-06 19956 0.229E-03
176 F= -.36775679E+03 E0= -.36776066E+03 d E =-.749098E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367765171888E+03 -0.83862E-02 -0.50179E+00 25536 0.728E+00 0.774E-01
DAV: 2 -0.367762868443E+03 0.23034E-02 -0.10786E-01 26886 0.104E+00 0.403E-01
DAV: 3 -0.367759322834E+03 0.35456E-02 -0.10509E-02 29562 0.355E-01 0.164E-01
DAV: 4 -0.367759045080E+03 0.27775E-03 -0.20872E-03 31140 0.159E-01 0.707E-02
DAV: 5 -0.367759072353E+03 -0.27273E-04 -0.25085E-04 29250 0.547E-02 0.336E-02
DAV: 6 -0.367759129709E+03 -0.57356E-04 -0.52147E-05 28776 0.294E-02 0.134E-02
DAV: 7 -0.367759181223E+03 -0.51514E-04 -0.10056E-05 20070 0.123E-02 0.489E-03
DAV: 8 -0.367759222329E+03 -0.41107E-04 -0.64229E-06 19914 0.811E-03 0.323E-03
DAV: 9 -0.367759267334E+03 -0.45005E-04 -0.33152E-06 19878 0.558E-03 0.200E-03
DAV: 10 -0.367759312738E+03 -0.45404E-04 -0.51744E-06 19860 0.510E-03 0.134E-03
DAV: 11 -0.367759335922E+03 -0.23184E-04 -0.29680E-06 20082 0.333E-03 0.988E-04
DAV: 12 -0.367759345158E+03 -0.92365E-05 -0.12255E-06 20010 0.236E-03
177 F= -.36775935E+03 E0= -.36776321E+03 d E =-.100415E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367770392409E+03 -0.11056E-01 -0.42821E+00 25536 0.671E+00 0.705E-01
DAV: 2 -0.367768652704E+03 0.17397E-02 -0.89798E-02 26868 0.954E-01 0.375E-01
DAV: 3 -0.367765651875E+03 0.30008E-02 -0.88359E-03 29598 0.334E-01 0.154E-01
DAV: 4 -0.367765408092E+03 0.24378E-03 -0.18149E-03 31104 0.151E-01 0.651E-02
DAV: 5 -0.367765425256E+03 -0.17163E-04 -0.22627E-04 29514 0.517E-02 0.313E-02
DAV: 6 -0.367765474511E+03 -0.49255E-04 -0.47643E-05 28692 0.269E-02 0.122E-02
DAV: 7 -0.367765516711E+03 -0.42200E-04 -0.80666E-06 20076 0.115E-02 0.454E-03
DAV: 8 -0.367765554931E+03 -0.38221E-04 -0.60967E-06 19812 0.804E-03 0.316E-03
DAV: 9 -0.367765593292E+03 -0.38361E-04 -0.27431E-06 19998 0.564E-03 0.188E-03
DAV: 10 -0.367765634669E+03 -0.41377E-04 -0.46077E-06 19674 0.556E-03 0.143E-03
DAV: 11 -0.367765655529E+03 -0.20860E-04 -0.27109E-06 20082 0.343E-03 0.964E-04
DAV: 12 -0.367765664067E+03 -0.85378E-05 -0.11702E-06 19836 0.244E-03
178 F= -.36776566E+03 E0= -.36776953E+03 d E =-.631891E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367772329303E+03 -0.66738E-02 -0.44621E+00 25536 0.685E+00 0.721E-01
DAV: 2 -0.367770475239E+03 0.18541E-02 -0.93654E-02 26880 0.975E-01 0.383E-01
DAV: 3 -0.367767340106E+03 0.31351E-02 -0.92206E-03 29598 0.341E-01 0.157E-01
DAV: 4 -0.367767085840E+03 0.25427E-03 -0.19001E-03 31092 0.154E-01 0.665E-02
DAV: 5 -0.367767103985E+03 -0.18145E-04 -0.23449E-04 29490 0.526E-02 0.320E-02
DAV: 6 -0.367767155377E+03 -0.51392E-04 -0.49680E-05 28680 0.274E-02 0.125E-02
DAV: 7 -0.367767199126E+03 -0.43748E-04 -0.83407E-06 20064 0.117E-02 0.462E-03
DAV: 8 -0.367767238809E+03 -0.39684E-04 -0.63850E-06 19788 0.821E-03 0.323E-03
DAV: 9 -0.367767278266E+03 -0.39457E-04 -0.28412E-06 20022 0.575E-03 0.190E-03
DAV: 10 -0.367767321195E+03 -0.42928E-04 -0.48384E-06 19602 0.570E-03 0.148E-03
DAV: 11 -0.367767342410E+03 -0.21215E-04 -0.27777E-06 20088 0.348E-03 0.977E-04
DAV: 12 -0.367767351210E+03 -0.88002E-05 -0.12174E-06 19734 0.248E-03
179 F= -.36776735E+03 E0= -.36777122E+03 d E =-.800605E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367776854630E+03 -0.95122E-02 -0.31674E+00 25536 0.575E+00 0.623E-01
DAV: 2 -0.367775082087E+03 0.17725E-02 -0.67649E-02 26790 0.823E-01 0.327E-01
DAV: 3 -0.367772666699E+03 0.24154E-02 -0.69051E-03 29562 0.297E-01 0.132E-01
DAV: 4 -0.367772486789E+03 0.17991E-03 -0.14934E-03 31104 0.135E-01 0.578E-02
DAV: 5 -0.367772501885E+03 -0.15096E-04 -0.16627E-04 29544 0.462E-02 0.278E-02
DAV: 6 -0.367772538926E+03 -0.37041E-04 -0.34833E-05 27552 0.238E-02 0.103E-02
DAV: 7 -0.367772572031E+03 -0.33105E-04 -0.61035E-06 19938 0.982E-03 0.394E-03
DAV: 8 -0.367772601871E+03 -0.29840E-04 -0.43082E-06 19980 0.707E-03 0.268E-03
DAV: 9 -0.367772632799E+03 -0.30928E-04 -0.23468E-06 19758 0.546E-03 0.164E-03
DAV: 10 -0.367772659160E+03 -0.26361E-04 -0.28754E-06 19812 0.488E-03 0.108E-03
DAV: 11 -0.367772673561E+03 -0.14401E-04 -0.16969E-06 19776 0.306E-03 0.836E-04
DAV: 12 -0.367772679582E+03 -0.60210E-05 -0.75216E-07 19854 0.203E-03
180 F= -.36777268E+03 E0= -.36777655E+03 d E =-.532837E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367810664855E+03 -0.37991E-01 -0.28477E+01 25536 0.172E+01 0.191E+00
DAV: 2 -0.367794450818E+03 0.16214E-01 -0.63759E-01 26958 0.251E+00 0.979E-01
DAV: 3 -0.367773484639E+03 0.20966E-01 -0.59297E-02 29688 0.885E-01 0.417E-01
DAV: 4 -0.367771791426E+03 0.16932E-02 -0.14423E-02 30948 0.415E-01 0.183E-01
DAV: 5 -0.367771939443E+03 -0.14802E-03 -0.15704E-03 28044 0.143E-01 0.879E-02
DAV: 6 -0.367772195946E+03 -0.25650E-03 -0.33374E-04 28854 0.734E-02 0.315E-02
DAV: 7 -0.367772409983E+03 -0.21404E-03 -0.59804E-05 29220 0.292E-02 0.118E-02
DAV: 8 -0.367772572392E+03 -0.16241E-03 -0.30766E-05 25248 0.193E-02 0.792E-03
DAV: 9 -0.367772725059E+03 -0.15267E-03 -0.13920E-05 21048 0.142E-02 0.466E-03
DAV: 10 -0.367772877026E+03 -0.15197E-03 -0.24550E-05 23952 0.145E-02 0.343E-03
DAV: 11 -0.367772942868E+03 -0.65843E-04 -0.77368E-06 21768 0.781E-03 0.227E-03
DAV: 12 -0.367772980142E+03 -0.37274E-04 -0.46637E-06 19722 0.551E-03 0.130E-03
DAV: 13 -0.367772995490E+03 -0.15348E-04 -0.23779E-06 20130 0.316E-03 0.919E-04
DAV: 14 -0.367773002004E+03 -0.65144E-05 -0.13166E-06 19356 0.280E-03
181 F= -.36777300E+03 E0= -.36777687E+03 d E =-.565079E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367784365890E+03 -0.11370E-01 -0.65112E+00 25536 0.824E+00 0.874E-01
DAV: 2 -0.367780996696E+03 0.33692E-02 -0.13429E-01 26850 0.117E+00 0.471E-01
DAV: 3 -0.367776018324E+03 0.49784E-02 -0.15074E-02 29784 0.431E-01 0.181E-01
DAV: 4 -0.367775692308E+03 0.32602E-03 -0.28869E-03 30876 0.190E-01 0.791E-02
DAV: 5 -0.367775677004E+03 0.15305E-04 -0.33825E-04 29532 0.655E-02 0.380E-02
DAV: 6 -0.367775694371E+03 -0.17368E-04 -0.69899E-05 28146 0.336E-02 0.147E-02
DAV: 7 -0.367775714204E+03 -0.19832E-04 -0.11087E-05 20184 0.140E-02 0.581E-03
DAV: 8 -0.367775735558E+03 -0.21354E-04 -0.67267E-06 19734 0.989E-03 0.392E-03
DAV: 9 -0.367775758391E+03 -0.22834E-04 -0.24173E-06 19728 0.748E-03 0.232E-03
DAV: 10 -0.367775778516E+03 -0.20125E-04 -0.29737E-06 19668 0.640E-03 0.157E-03
DAV: 11 -0.367775789075E+03 -0.10559E-04 -0.13487E-06 20040 0.365E-03 0.113E-03
DAV: 12 -0.367775794287E+03 -0.52121E-05 -0.59227E-07 19260 0.223E-03
182 F= -.36777579E+03 E0= -.36777966E+03 d E =-.844308E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367789042659E+03 -0.13254E-01 -0.42471E+00 25536 0.668E+00 0.728E-01
DAV: 2 -0.367786343973E+03 0.26987E-02 -0.89566E-02 27546 0.961E-01 0.385E-01
DAV: 3 -0.367783115160E+03 0.32288E-02 -0.96940E-03 29604 0.350E-01 0.154E-01
DAV: 4 -0.367782861035E+03 0.25412E-03 -0.19053E-03 31140 0.153E-01 0.668E-02
DAV: 5 -0.367782877470E+03 -0.16435E-04 -0.25552E-04 28128 0.572E-02 0.316E-02
DAV: 6 -0.367782924271E+03 -0.46801E-04 -0.50517E-05 29016 0.286E-02 0.127E-02
DAV: 7 -0.367782968718E+03 -0.44447E-04 -0.91428E-06 19878 0.114E-02 0.456E-03
DAV: 8 -0.367783004862E+03 -0.36144E-04 -0.47900E-06 19950 0.718E-03 0.282E-03
DAV: 9 -0.367783049831E+03 -0.44969E-04 -0.37680E-06 19518 0.597E-03 0.196E-03
DAV: 10 -0.367783080499E+03 -0.30668E-04 -0.34571E-06 19980 0.484E-03 0.117E-03
DAV: 11 -0.367783100388E+03 -0.19889E-04 -0.24624E-06 19518 0.349E-03 0.975E-04
DAV: 12 -0.367783107752E+03 -0.73634E-05 -0.10918E-06 20196 0.251E-03
183 F= -.36778311E+03 E0= -.36778697E+03 d E =-.731346E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367796030891E+03 -0.12931E-01 -0.73752E+00 25536 0.879E+00 0.966E-01
DAV: 2 -0.367791169526E+03 0.48614E-02 -0.15632E-01 27060 0.127E+00 0.508E-01
DAV: 3 -0.367785590121E+03 0.55794E-02 -0.16821E-02 29562 0.462E-01 0.205E-01
DAV: 4 -0.367785153677E+03 0.43644E-03 -0.33341E-03 31020 0.203E-01 0.889E-02
DAV: 5 -0.367785184198E+03 -0.30520E-04 -0.44457E-04 27780 0.755E-02 0.420E-02
DAV: 6 -0.367785263354E+03 -0.79156E-04 -0.88615E-05 29052 0.380E-02 0.168E-02
DAV: 7 -0.367785337138E+03 -0.73784E-04 -0.16106E-05 19950 0.151E-02 0.601E-03
DAV: 8 -0.367785395166E+03 -0.58028E-04 -0.83293E-06 20094 0.952E-03 0.372E-03
DAV: 9 -0.367785467336E+03 -0.72170E-04 -0.66386E-06 19470 0.793E-03 0.261E-03
DAV: 10 -0.367785516596E+03 -0.49259E-04 -0.63364E-06 20592 0.651E-03 0.157E-03
DAV: 11 -0.367785547661E+03 -0.31065E-04 -0.38904E-06 19638 0.451E-03 0.129E-03
DAV: 12 -0.367785558706E+03 -0.11045E-04 -0.17243E-06 20364 0.320E-03 0.598E-04
DAV: 13 -0.367785564450E+03 -0.57448E-05 -0.11715E-06 19026 0.205E-03
184 F= -.36778556E+03 E0= -.36778943E+03 d E =-.977016E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367798097026E+03 -0.12538E-01 -0.42690E+00 25536 0.668E+00 0.750E-01
DAV: 2 -0.367794602069E+03 0.34950E-02 -0.89065E-02 27084 0.965E-01 0.388E-01
DAV: 3 -0.367791358331E+03 0.32437E-02 -0.10264E-02 29556 0.359E-01 0.154E-01
DAV: 4 -0.367791115262E+03 0.24307E-03 -0.19170E-03 31104 0.157E-01 0.673E-02
DAV: 5 -0.367791132298E+03 -0.17036E-04 -0.26897E-04 28020 0.583E-02 0.322E-02
DAV: 6 -0.367791183954E+03 -0.51657E-04 -0.53047E-05 28944 0.291E-02 0.128E-02
DAV: 7 -0.367791231958E+03 -0.48003E-04 -0.93318E-06 19830 0.116E-02 0.468E-03
DAV: 8 -0.367791272482E+03 -0.40525E-04 -0.52482E-06 20034 0.760E-03 0.286E-03
DAV: 9 -0.367791319405E+03 -0.46922E-04 -0.37098E-06 19620 0.590E-03 0.192E-03
DAV: 10 -0.367791355200E+03 -0.35795E-04 -0.40306E-06 19896 0.516E-03 0.121E-03
DAV: 11 -0.367791376031E+03 -0.20831E-04 -0.26417E-06 19626 0.352E-03 0.946E-04
DAV: 12 -0.367791384051E+03 -0.80199E-05 -0.12148E-06 19986 0.252E-03
185 F= -.36779138E+03 E0= -.36779525E+03 d E =-.581960E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.367819805291E+03 -0.28429E-01 -0.15126E+01 25536 0.126E+01 0.143E+00
DAV: 2 -0.367806970543E+03 0.12835E-01 -0.32213E-01 27204 0.183E+00 0.729E-01
DAV: 3 -0.367795650684E+03 0.11320E-01 -0.35820E-02 29604 0.676E-01 0.295E-01
DAV: 4 -0.367794802544E+03 0.84814E-03 -0.70177E-03 30948 0.298E-01 0.130E-01
DAV: 5 -0.367794868832E+03 -0.66288E-04 -0.95964E-04 27540 0.111E-01 0.622E-02