N E dE d eps ncg rms rms(c)
DAV: 1 0.278117985244E+04 0.27812E+04 -0.20403E+05 1568 0.103E+03
DAV: 2 -0.480203811927E+03 -0.32614E+04 -0.31012E+04 1904 0.226E+02
DAV: 3 -0.917073604766E+03 -0.43687E+03 -0.43096E+03 1936 0.846E+01
DAV: 4 -0.934198896268E+03 -0.17125E+02 -0.17033E+02 1872 0.182E+01
DAV: 5 -0.934872626216E+03 -0.67373E+00 -0.67317E+00 2168 0.329E+00 0.537E+01
DAV: 6 -0.874900166957E+03 0.59972E+02 -0.19500E+02 2048 0.271E+01 0.322E+01
DAV: 7 -0.874772493940E+03 0.12767E+00 -0.55160E+01 1696 0.966E+00 0.156E+01
DAV: 8 -0.873297128738E+03 0.14754E+01 -0.11336E+01 1808 0.625E+00 0.672E+00
DAV: 9 -0.873025737731E+03 0.27139E+00 -0.31931E+00 1984 0.352E+00 0.902E+00
DAV: 10 -0.872645340666E+03 0.38040E+00 -0.65598E+00 1768 0.141E+00 0.215E+00
DAV: 11 -0.872731035643E+03 -0.85695E-01 -0.57756E-01 1984 0.807E-01 0.164E+00
DAV: 12 -0.872692551846E+03 0.38484E-01 -0.81380E-02 1864 0.465E-01 0.106E+00
DAV: 13 -0.872703411439E+03 -0.10860E-01 -0.18522E-01 1736 0.355E-01 0.879E-01
DAV: 14 -0.872703482451E+03 -0.71012E-04 -0.67537E-02 1864 0.210E-01 0.512E-01
DAV: 15 -0.872710179608E+03 -0.66972E-02 -0.89103E-02 2064 0.181E-01 0.800E-01
DAV: 16 -0.872705053127E+03 0.51265E-02 -0.11807E-02 1904 0.100E-01 0.219E-01
DAV: 17 -0.872707189124E+03 -0.21360E-02 -0.28918E-03 1944 0.624E-02 0.752E-02
DAV: 18 -0.872709426656E+03 -0.22375E-02 -0.76611E-04 1744 0.351E-02 0.569E-02
DAV: 19 -0.872711344830E+03 -0.19182E-02 -0.70674E-04 1728 0.252E-02 0.118E-01
DAV: 20 -0.872712902374E+03 -0.15575E-02 -0.95176E-04 1832 0.250E-02 0.550E-02
DAV: 21 -0.872713831982E+03 -0.92961E-03 -0.29615E-04 1632 0.179E-02 0.547E-02
DAV: 22 -0.872714316091E+03 -0.48411E-03 -0.22020E-04 1672 0.119E-02 0.263E-02
DAV: 23 -0.872714509386E+03 -0.19330E-03 -0.13610E-05 1184 0.782E-03 0.159E-02
DAV: 24 -0.872714812021E+03 -0.30263E-03 -0.36194E-05 1544 0.905E-03 0.116E-02
DAV: 25 -0.872714867779E+03 -0.55758E-04 -0.72234E-06 936 0.506E-03 0.157E-02
DAV: 26 -0.872714902386E+03 -0.34607E-04 -0.88217E-06 904 0.487E-03 0.114E-02
DAV: 27 -0.872714950332E+03 -0.47947E-04 -0.73565E-06 968 0.305E-03 0.563E-03
DAV: 28 -0.872714966683E+03 -0.16351E-04 -0.30399E-06 904 0.247E-03 0.348E-03
DAV: 29 -0.872714968762E+03 -0.20790E-05 -0.76789E-07 840 0.142E-03
1 F= -.87271497E+03 E0= -.87273216E+03 d E =-.872715E+03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.842771716038E+03 0.29943E+02 -0.51561E+03 1584 0.125E+02 0.332E+01
DAV: 2 -0.878660845625E+03 -0.35889E+02 -0.43722E+02 1872 0.301E+01 0.167E+01
DAV: 3 -0.875351313630E+03 0.33095E+01 -0.18035E+01 1752 0.740E+00 0.114E+01
DAV: 4 -0.873660606873E+03 0.16907E+01 -0.20230E+01 1752 0.683E+00 0.398E+00
DAV: 5 -0.873456538171E+03 0.20407E+00 -0.11327E+00 1920 0.228E+00 0.307E+00
DAV: 6 -0.873374952841E+03 0.81585E-01 -0.83524E-01 1896 0.162E+00 0.153E+00
DAV: 7 -0.873381227352E+03 -0.62745E-02 -0.30908E-01 1760 0.798E-01 0.573E-01
DAV: 8 -0.873382476921E+03 -0.12496E-02 -0.47787E-02 2096 0.386E-01 0.250E-01
DAV: 9 -0.873383919733E+03 -0.14428E-02 -0.10239E-02 1816 0.149E-01 0.221E-01
DAV: 10 -0.873384031591E+03 -0.11186E-03 -0.21931E-03 1896 0.775E-02 0.890E-02
DAV: 11 -0.873384465297E+03 -0.43371E-03 -0.10887E-03 1848 0.499E-02 0.354E-02
DAV: 12 -0.873384868700E+03 -0.40340E-03 -0.21378E-04 1896 0.258E-02 0.286E-02
DAV: 13 -0.873385299778E+03 -0.43108E-03 -0.25092E-04 1768 0.246E-02 0.277E-02
DAV: 14 -0.873385520905E+03 -0.22113E-03 -0.88451E-05 1816 0.178E-02 0.169E-02
DAV: 15 -0.873385603897E+03 -0.82993E-04 -0.58510E-05 1688 0.139E-02 0.865E-03
DAV: 16 -0.873385688446E+03 -0.84549E-04 -0.14525E-05 1312 0.757E-03 0.705E-03
DAV: 17 -0.873385766131E+03 -0.77685E-04 -0.11098E-05 1288 0.553E-03 0.650E-03
DAV: 18 -0.873385830263E+03 -0.64131E-04 -0.10165E-05 1280 0.658E-03 0.477E-03
DAV: 19 -0.873385864709E+03 -0.34446E-04 -0.50745E-06 1184 0.425E-03 0.356E-03
DAV: 20 -0.873385898333E+03 -0.33624E-04 -0.48517E-06 1160 0.359E-03 0.348E-03
DAV: 21 -0.873385914494E+03 -0.16160E-04 -0.13832E-06 1096 0.275E-03 0.197E-03
DAV: 22 -0.873385926054E+03 -0.11560E-04 -0.32935E-06 1120 0.288E-03 0.276E-03
DAV: 23 -0.873385927295E+03 -0.12416E-05 -0.58251E-07 1000 0.168E-03
2 F= -.87338593E+03 E0= -.87339135E+03 d E =-.670959E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.875138553931E+03 -0.17526E+01 -0.12804E+03 1544 0.620E+01 0.117E+01
DAV: 2 -0.881097747349E+03 -0.59592E+01 -0.69409E+01 1832 0.118E+01 0.632E+00
DAV: 3 -0.880520537060E+03 0.57721E+00 -0.26543E+00 1968 0.338E+00 0.373E+00
DAV: 4 -0.880377210260E+03 0.14333E+00 -0.10589E+00 1808 0.176E+00 0.168E+00
DAV: 5 -0.880367685080E+03 0.95252E-02 -0.26997E-01 1760 0.879E-01 0.769E-01
DAV: 6 -0.880373046647E+03 -0.53616E-02 -0.91446E-02 1984 0.551E-01 0.476E-01
DAV: 7 -0.880369353521E+03 0.36931E-02 -0.15937E-02 1872 0.218E-01 0.406E-01
DAV: 8 -0.880365517861E+03 0.38357E-02 -0.45262E-03 1904 0.997E-02 0.332E-01
DAV: 9 -0.880361100030E+03 0.44178E-02 -0.35582E-03 2088 0.875E-02 0.280E-01
DAV: 10 -0.880358717512E+03 0.23825E-02 -0.51168E-03 1984 0.770E-02 0.196E-01
DAV: 11 -0.880358388413E+03 0.32910E-03 -0.32857E-03 1936 0.751E-02 0.216E-01
DAV: 12 -0.880361724368E+03 -0.33360E-02 -0.72866E-03 2032 0.114E-01 0.226E-01
DAV: 13 -0.880360175559E+03 0.15488E-02 -0.30292E-03 1704 0.657E-02 0.224E-01
DAV: 14 -0.880359094282E+03 0.10813E-02 -0.26931E-03 1936 0.466E-02 0.152E-01
DAV: 15 -0.880358824433E+03 0.26985E-03 -0.96436E-04 1952 0.493E-02 0.128E-01
DAV: 16 -0.880359369373E+03 -0.54494E-03 -0.78947E-04 2040 0.400E-02 0.178E-01
DAV: 17 -0.880359100977E+03 0.26840E-03 -0.36674E-03 2080 0.416E-02 0.821E-02
DAV: 18 -0.880359489844E+03 -0.38887E-03 -0.62152E-04 1896 0.344E-02 0.910E-02
DAV: 19 -0.880359415397E+03 0.74447E-04 -0.45929E-04 1744 0.201E-02 0.314E-02
DAV: 20 -0.880359537447E+03 -0.12205E-03 -0.14760E-04 1656 0.122E-02 0.148E-02
DAV: 21 -0.880359583789E+03 -0.46342E-04 -0.21536E-05 1240 0.553E-03 0.164E-02
DAV: 22 -0.880359622599E+03 -0.38810E-04 -0.10188E-05 1072 0.344E-03 0.233E-02
DAV: 23 -0.880359662445E+03 -0.39846E-04 -0.79438E-05 1296 0.664E-03 0.118E-02
DAV: 24 -0.880359686309E+03 -0.23863E-04 -0.28318E-05 1272 0.427E-03 0.246E-02
DAV: 25 -0.880359683594E+03 0.27145E-05 -0.83795E-06 872 0.221E-03
3 F= -.88035968E+03 E0= -.88037521E+03 d E =-.764471E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.873228238629E+03 0.71314E+01 -0.29198E+03 1536 0.931E+01 0.136E+01
DAV: 2 -0.887915278863E+03 -0.14687E+02 -0.15680E+02 1800 0.174E+01 0.994E+00
DAV: 3 -0.886580581250E+03 0.13347E+01 -0.27097E+00 1888 0.346E+00 0.679E+00
DAV: 4 -0.886187567367E+03 0.39301E+00 -0.10107E+01 1696 0.533E+00 0.356E+00
DAV: 5 -0.885976541175E+03 0.21103E+00 -0.11544E+00 1672 0.206E+00 0.213E+00
DAV: 6 -0.885976589342E+03 -0.48167E-04 -0.28380E-01 1744 0.788E-01 0.124E+00
DAV: 7 -0.885956592272E+03 0.19997E-01 -0.11324E-01 2312 0.636E-01 0.437E-01
DAV: 8 -0.885959059821E+03 -0.24675E-02 -0.43022E-02 1664 0.311E-01 0.257E-01
DAV: 9 -0.885960008895E+03 -0.94907E-03 -0.88133E-03 1952 0.180E-01 0.234E-01
DAV: 10 -0.885959433199E+03 0.57570E-03 -0.16623E-03 1832 0.805E-02 0.164E-01
DAV: 11 -0.885959343344E+03 0.89855E-04 -0.35706E-03 1744 0.946E-02 0.427E-02
DAV: 12 -0.885959381196E+03 -0.37853E-04 -0.31033E-04 1776 0.304E-02 0.401E-02
DAV: 13 -0.885959408309E+03 -0.27113E-04 -0.59518E-05 1600 0.136E-02 0.257E-02
DAV: 14 -0.885959446567E+03 -0.38257E-04 -0.20239E-05 1440 0.101E-02 0.165E-02
DAV: 15 -0.885959454395E+03 -0.78277E-05 -0.25265E-05 1224 0.628E-03
4 F= -.88595945E+03 E0= -.88597237E+03 d E =-.559977E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.885954191278E+03 0.52553E-02 -0.86047E+00 1536 0.513E+00 0.604E-01
DAV: 2 -0.885978706707E+03 -0.24515E-01 -0.27610E-01 1768 0.775E-01 0.350E-01
DAV: 3 -0.885977676013E+03 0.10307E-02 -0.41650E-03 1912 0.113E-01 0.236E-01
DAV: 4 -0.885976805986E+03 0.87003E-03 -0.25580E-03 1816 0.105E-01 0.642E-02
DAV: 5 -0.885976959545E+03 -0.15356E-03 -0.17321E-03 1736 0.610E-02 0.445E-02
DAV: 6 -0.885976964898E+03 -0.53532E-05 -0.11085E-04 1760 0.176E-02 0.335E-02
DAV: 7 -0.885976967398E+03 -0.24993E-05 -0.29353E-05 1216 0.913E-03
5 F= -.88597697E+03 E0= -.88598996E+03 d E =-.561728E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.881011464191E+03 0.49655E+01 -0.22179E+03 1544 0.814E+01 0.123E+01
DAV: 2 -0.890468658883E+03 -0.94572E+01 -0.10884E+02 1744 0.144E+01 0.702E+00
DAV: 3 -0.889836405189E+03 0.63225E+00 -0.17431E+00 1888 0.271E+00 0.478E+00
DAV: 4 -0.889596269801E+03 0.24014E+00 -0.39736E+00 1832 0.312E+00 0.217E+00
DAV: 5 -0.889606730102E+03 -0.10460E-01 -0.66334E-01 1752 0.123E+00 0.190E+00
DAV: 6 -0.889569885768E+03 0.36844E-01 -0.13410E-01 1760 0.535E-01 0.103E+00
DAV: 7 -0.889561084192E+03 0.88016E-02 -0.14209E-01 1776 0.539E-01 0.919E-01
DAV: 8 -0.889555484456E+03 0.55997E-02 -0.30060E-02 1856 0.235E-01 0.267E-01
DAV: 9 -0.889556199946E+03 -0.71549E-03 -0.63303E-03 1784 0.146E-01 0.141E-01
DAV: 10 -0.889556719539E+03 -0.51959E-03 -0.25622E-03 1904 0.670E-02 0.102E-01
DAV: 11 -0.889556998345E+03 -0.27881E-03 -0.91604E-04 2088 0.543E-02 0.714E-02
DAV: 12 -0.889556958414E+03 0.39932E-04 -0.72909E-04 1944 0.401E-02 0.720E-02
DAV: 13 -0.889556953912E+03 0.45015E-05 -0.30440E-04 1392 0.151E-02 0.759E-02
DAV: 14 -0.889556840818E+03 0.11309E-03 -0.74659E-05 1496 0.125E-02 0.822E-02
DAV: 15 -0.889557173318E+03 -0.33250E-03 -0.39402E-04 1816 0.342E-02 0.714E-02
DAV: 16 -0.889558089448E+03 -0.91613E-03 -0.30954E-03 2192 0.694E-02 0.119E-01
DAV: 17 -0.889558382321E+03 -0.29287E-03 -0.10964E-03 1808 0.263E-02 0.123E-01
DAV: 18 -0.889558418284E+03 -0.35963E-04 -0.54016E-05 1200 0.830E-03 0.119E-01
DAV: 19 -0.889558404891E+03 0.13393E-04 -0.82005E-06 976 0.471E-03 0.119E-01
DAV: 20 -0.889557608132E+03 0.79676E-03 -0.18365E-03 2000 0.578E-02 0.115E-01
DAV: 21 -0.889557651635E+03 -0.43503E-04 -0.57862E-04 1696 0.173E-02 0.107E-01
DAV: 22 -0.889557645557E+03 0.60776E-05 -0.13219E-05 1184 0.326E-03
6 F= -.88955765E+03 E0= -.88958045E+03 d E =-.358068E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.889554432320E+03 0.32193E-02 -0.30341E+00 1560 0.300E+00 0.432E-01
DAV: 2 -0.889563108233E+03 -0.86759E-02 -0.10211E-01 1752 0.487E-01 0.215E-01
DAV: 3 -0.889562370344E+03 0.73789E-03 -0.38886E-03 1920 0.987E-02 0.158E-01
DAV: 4 -0.889561678808E+03 0.69154E-03 -0.19387E-03 1920 0.646E-02 0.207E-01
DAV: 5 -0.889560422483E+03 0.12563E-02 -0.23760E-03 2000 0.491E-02 0.107E-01
DAV: 6 -0.889559878035E+03 0.54445E-03 -0.49136E-03 2056 0.582E-02 0.146E-01
DAV: 7 -0.889559963620E+03 -0.85585E-04 -0.57980E-03 1952 0.507E-02 0.761E-02
DAV: 8 -0.889559552517E+03 0.41110E-03 -0.68968E-04 1800 0.279E-02 0.502E-02
DAV: 9 -0.889559435220E+03 0.11730E-03 -0.50295E-04 1592 0.185E-02 0.184E-02
DAV: 10 -0.889559495765E+03 -0.60545E-04 -0.10220E-04 1304 0.113E-02 0.136E-02
DAV: 11 -0.889559513474E+03 -0.17709E-04 -0.29821E-05 1352 0.891E-03 0.110E-02
DAV: 12 -0.889559537036E+03 -0.23563E-04 -0.36658E-05 1144 0.693E-03 0.450E-03
DAV: 13 -0.889559563055E+03 -0.26019E-04 -0.15206E-05 1112 0.366E-03 0.649E-03
DAV: 14 -0.889559580197E+03 -0.17142E-04 -0.60120E-06 912 0.185E-03 0.206E-03
DAV: 15 -0.889559602149E+03 -0.21952E-04 -0.53680E-06 1040 0.173E-03 0.187E-03
DAV: 16 -0.889559607306E+03 -0.51572E-05 -0.93498E-07 840 0.890E-04
7 F= -.88955961E+03 E0= -.88958595E+03 d E =-.358264E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.880694399831E+03 0.88652E+01 -0.21374E+03 1568 0.788E+01 0.136E+01
DAV: 2 -0.890579221667E+03 -0.98848E+01 -0.11953E+02 1776 0.154E+01 0.736E+00
DAV: 3 -0.890021547938E+03 0.55767E+00 -0.31003E+00 1840 0.316E+00 0.527E+00
DAV: 4 -0.889698121891E+03 0.32343E+00 -0.29306E+00 1768 0.276E+00 0.213E+00
DAV: 5 -0.889722343522E+03 -0.24222E-01 -0.51597E-01 1816 0.112E+00 0.184E+00
DAV: 6 -0.889708357964E+03 0.13986E-01 -0.11121E-01 2136 0.660E-01 0.137E+00
DAV: 7 -0.889691711460E+03 0.16647E-01 -0.33932E-01 1800 0.699E-01 0.583E-01
DAV: 8 -0.889688781169E+03 0.29303E-02 -0.31240E-02 1800 0.250E-01 0.403E-01
DAV: 9 -0.889685225255E+03 0.35559E-02 -0.12684E-02 1936 0.158E-01 0.297E-01
DAV: 10 -0.889681618371E+03 0.36069E-02 -0.12421E-02 2192 0.141E-01 0.193E-01
DAV: 11 -0.889681925724E+03 -0.30735E-03 -0.61674E-03 2016 0.125E-01 0.271E-01
DAV: 12 -0.889681402064E+03 0.52366E-03 -0.84823E-03 2152 0.115E-01 0.137E-01
DAV: 13 -0.889681484040E+03 -0.81976E-04 -0.21171E-03 1816 0.587E-02 0.165E-01
DAV: 14 -0.889681133731E+03 0.35031E-03 -0.52978E-03 2080 0.596E-02 0.866E-02
DAV: 15 -0.889681160015E+03 -0.26284E-04 -0.51316E-04 1640 0.263E-02 0.520E-02
DAV: 16 -0.889681181626E+03 -0.21611E-04 -0.61910E-05 1616 0.137E-02 0.315E-02
DAV: 17 -0.889681236662E+03 -0.55036E-04 -0.30086E-04 1744 0.152E-02 0.234E-02
DAV: 18 -0.889681263751E+03 -0.27088E-04 -0.37053E-05 1232 0.748E-03 0.156E-02
DAV: 19 -0.889681295157E+03 -0.31407E-04 -0.89927E-06 1160 0.464E-03 0.134E-02
DAV: 20 -0.889681308187E+03 -0.13030E-04 -0.92036E-06 1016 0.356E-03 0.667E-03
DAV: 21 -0.889681327131E+03 -0.18944E-04 -0.15775E-05 1128 0.456E-03 0.644E-03
DAV: 22 -0.889681338011E+03 -0.10880E-04 -0.10181E-05 1016 0.272E-03 0.360E-03
DAV: 23 -0.889681341478E+03 -0.34667E-05 -0.12889E-06 880 0.157E-03
8 F= -.88968134E+03 E0= -.88970737E+03 d E =-.121734E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.888745806287E+03 0.93553E+00 -0.56983E+02 1560 0.409E+01 0.528E+00
DAV: 2 -0.890868052156E+03 -0.21222E+01 -0.23122E+01 1752 0.705E+00 0.328E+00
DAV: 3 -0.890743538242E+03 0.12451E+00 -0.45805E-01 2032 0.132E+00 0.209E+00
DAV: 4 -0.890738233622E+03 0.53046E-02 -0.36004E-01 1808 0.114E+00 0.236E+00
DAV: 5 -0.890700614634E+03 0.37619E-01 -0.44042E-01 2008 0.587E-01 0.782E-01
DAV: 6 -0.890702934769E+03 -0.23201E-02 -0.42315E-02 2016 0.355E-01 0.507E-01
DAV: 7 -0.890702102306E+03 0.83246E-03 -0.15485E-02 1880 0.232E-01 0.260E-01
DAV: 8 -0.890702170356E+03 -0.68051E-04 -0.12969E-02 1888 0.133E-01 0.173E-01
DAV: 9 -0.890701975621E+03 0.19474E-03 -0.17267E-03 1808 0.582E-02 0.110E-01
DAV: 10 -0.890701935366E+03 0.40255E-04 -0.25742E-04 1864 0.257E-02 0.645E-02
DAV: 11 -0.890701977746E+03 -0.42380E-04 -0.28162E-04 1808 0.267E-02 0.462E-02
DAV: 12 -0.890701993379E+03 -0.15632E-04 -0.19657E-04 2000 0.216E-02 0.216E-02
DAV: 13 -0.890702011213E+03 -0.17835E-04 -0.29708E-05 1264 0.911E-03 0.136E-02
DAV: 14 -0.890702029501E+03 -0.18288E-04 -0.15972E-05 1176 0.669E-03 0.758E-03
DAV: 15 -0.890702053639E+03 -0.24138E-04 -0.12269E-05 1176 0.613E-03 0.613E-03
DAV: 16 -0.890702061400E+03 -0.77610E-05 -0.32816E-06 936 0.405E-03
9 F= -.89070206E+03 E0= -.89072826E+03 d E =-.114245E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.890025298177E+03 0.67676E+00 -0.53528E+02 1536 0.401E+01 0.621E+00
DAV: 2 -0.892008318064E+03 -0.19830E+01 -0.21341E+01 1736 0.683E+00 0.334E+00
DAV: 3 -0.891845843532E+03 0.16247E+00 -0.43088E-01 1856 0.118E+00 0.203E+00
DAV: 4 -0.891759836945E+03 0.86007E-01 -0.50674E-01 1752 0.113E+00 0.789E-01
DAV: 5 -0.891758972424E+03 0.86452E-03 -0.10777E-01 1752 0.546E-01 0.404E-01
DAV: 6 -0.891761977785E+03 -0.30054E-02 -0.24356E-02 1976 0.294E-01 0.382E-01
DAV: 7 -0.891759656095E+03 0.23217E-02 -0.89272E-03 1936 0.158E-01 0.151E-01
DAV: 8 -0.891759942823E+03 -0.28673E-03 -0.21803E-03 1720 0.630E-02 0.102E-01
DAV: 9 -0.891760056174E+03 -0.11335E-03 -0.13081E-03 1888 0.367E-02 0.746E-02
DAV: 10 -0.891760076244E+03 -0.20070E-04 -0.69159E-04 1744 0.242E-02 0.278E-02
DAV: 11 -0.891760154613E+03 -0.78369E-04 -0.11447E-04 1760 0.179E-02 0.152E-02
DAV: 12 -0.891760208306E+03 -0.53693E-04 -0.27544E-05 1232 0.782E-03 0.115E-02
DAV: 13 -0.891760253789E+03 -0.45484E-04 -0.91871E-06 1112 0.590E-03 0.655E-03
DAV: 14 -0.891760305319E+03 -0.51529E-04 -0.21763E-05 1392 0.708E-03 0.623E-03
DAV: 15 -0.891760320468E+03 -0.15150E-04 -0.31413E-06 1024 0.410E-03 0.471E-03
DAV: 16 -0.891760330266E+03 -0.97976E-05 -0.68114E-06 1008 0.454E-03
10 F= -.89176033E+03 E0= -.89177377E+03 d E =-.105827E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.891757417495E+03 0.29030E-02 -0.77311E+00 1536 0.482E+00 0.717E-01
DAV: 2 -0.891782371061E+03 -0.24954E-01 -0.27503E-01 1776 0.791E-01 0.394E-01
DAV: 3 -0.891780866349E+03 0.15047E-02 -0.87678E-03 1824 0.164E-01 0.293E-01
DAV: 4 -0.891780001535E+03 0.86481E-03 -0.30840E-03 1808 0.868E-02 0.195E-01
DAV: 5 -0.891779619941E+03 0.38159E-03 -0.45991E-03 1880 0.951E-02 0.138E-01
DAV: 6 -0.891779465912E+03 0.15403E-03 -0.37870E-03 1920 0.598E-02 0.536E-02
DAV: 7 -0.891779497678E+03 -0.31766E-04 -0.30697E-04 1640 0.182E-02 0.304E-02
DAV: 8 -0.891779504825E+03 -0.71466E-05 -0.87348E-05 1464 0.125E-02
11 F= -.89177950E+03 E0= -.89179291E+03 d E =-.107744E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.891409123029E+03 0.37037E+00 -0.15594E+02 1536 0.220E+01 0.293E+00
DAV: 2 -0.891994636487E+03 -0.58551E+00 -0.65656E+00 1752 0.384E+00 0.192E+00
DAV: 3 -0.891956013645E+03 0.38623E-01 -0.23738E-01 1920 0.883E-01 0.125E+00
DAV: 4 -0.891951607175E+03 0.44065E-02 -0.15719E-01 1880 0.463E-01 0.104E+00
DAV: 5 -0.891940283624E+03 0.11324E-01 -0.14397E-01 1984 0.309E-01 0.494E-01
DAV: 6 -0.891940200034E+03 0.83590E-04 -0.18935E-02 1760 0.211E-01 0.432E-01
DAV: 7 -0.891938911199E+03 0.12888E-02 -0.15420E-02 1880 0.149E-01 0.188E-01
DAV: 8 -0.891938807473E+03 0.10373E-03 -0.26139E-03 1808 0.900E-02 0.912E-02
DAV: 9 -0.891938920668E+03 -0.11320E-03 -0.13973E-03 1808 0.472E-02 0.703E-02
DAV: 10 -0.891938908406E+03 0.12262E-04 -0.33981E-04 1792 0.266E-02 0.362E-02
DAV: 11 -0.891938937877E+03 -0.29471E-04 -0.24745E-04 1736 0.238E-02 0.146E-02
DAV: 12 -0.891938958795E+03 -0.20918E-04 -0.23850E-05 1224 0.789E-03 0.120E-02
DAV: 13 -0.891938981937E+03 -0.23142E-04 -0.11314E-05 1120 0.658E-03 0.566E-03
DAV: 14 -0.891939005797E+03 -0.23860E-04 -0.12439E-05 1112 0.627E-03 0.517E-03
DAV: 15 -0.891939025084E+03 -0.19286E-04 -0.29488E-06 1048 0.418E-03 0.352E-03
DAV: 16 -0.891939042938E+03 -0.17855E-04 -0.51967E-06 1072 0.394E-03 0.332E-03
DAV: 17 -0.891939052620E+03 -0.96813E-05 -0.17013E-06 1008 0.220E-03
12 F= -.89193905E+03 E0= -.89195251E+03 d E =-.159548E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.891969791619E+03 -0.30749E-01 -0.21330E+01 1536 0.815E+00 0.108E+00
DAV: 2 -0.892047045992E+03 -0.77254E-01 -0.88038E-01 1752 0.142E+00 0.708E-01
DAV: 3 -0.892042882346E+03 0.41636E-02 -0.38111E-02 1904 0.340E-01 0.486E-01
DAV: 4 -0.892043287616E+03 -0.40527E-03 -0.41655E-02 2096 0.172E-01 0.517E-01
DAV: 5 -0.892040187149E+03 0.31005E-02 -0.14275E-02 1920 0.122E-01 0.188E-01
DAV: 6 -0.892040466487E+03 -0.27934E-03 -0.33241E-03 1784 0.976E-02 0.141E-01
DAV: 7 -0.892040271625E+03 0.19486E-03 -0.17504E-03 1808 0.621E-02 0.621E-02
DAV: 8 -0.892040295785E+03 -0.24160E-04 -0.36464E-04 1736 0.323E-02 0.356E-02
DAV: 9 -0.892040303331E+03 -0.75458E-05 -0.11179E-04 1656 0.165E-02 0.253E-02
DAV: 10 -0.892040303996E+03 -0.66444E-06 -0.20210E-05 1240 0.100E-02
13 F= -.89204030E+03 E0= -.89205372E+03 d E =-.260799E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.892148712426E+03 -0.10841E+00 -0.95890E+01 1536 0.171E+01 0.214E+00
DAV: 2 -0.892428887606E+03 -0.28018E+00 -0.32143E+00 1768 0.272E+00 0.124E+00
DAV: 3 -0.892418220539E+03 0.10667E-01 -0.12311E-01 1888 0.471E-01 0.936E-01
DAV: 4 -0.892416660814E+03 0.15597E-02 -0.94707E-02 1920 0.239E-01 0.775E-01
DAV: 5 -0.892410378379E+03 0.62824E-02 -0.44383E-02 1848 0.295E-01 0.320E-01
DAV: 6 -0.892410273586E+03 0.10479E-03 -0.14084E-02 1800 0.167E-01 0.180E-01
DAV: 7 -0.892410093195E+03 0.18039E-03 -0.14945E-03 1888 0.659E-02 0.104E-01
DAV: 8 -0.892410021104E+03 0.72091E-04 -0.11091E-03 1784 0.469E-02 0.468E-02
DAV: 9 -0.892410021003E+03 0.10124E-06 -0.14265E-04 1920 0.237E-02 0.223E-02
DAV: 10 -0.892410034713E+03 -0.13710E-04 -0.73648E-05 1648 0.138E-02 0.111E-02
DAV: 11 -0.892410045183E+03 -0.10470E-04 -0.81855E-06 920 0.543E-03 0.522E-03
DAV: 12 -0.892410060833E+03 -0.15651E-04 -0.11543E-05 1080 0.564E-03 0.581E-03
DAV: 13 -0.892410065107E+03 -0.42741E-05 -0.26459E-06 824 0.300E-03
14 F= -.89241007E+03 E0= -.89242377E+03 d E =-.369761E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.892227929535E+03 0.18213E+00 -0.11696E+02 1536 0.188E+01 0.240E+00
DAV: 2 -0.892573012211E+03 -0.34508E+00 -0.39501E+00 1768 0.301E+00 0.146E+00
DAV: 3 -0.892563916917E+03 0.90953E-02 -0.23855E-01 1968 0.542E-01 0.109E+00
DAV: 4 -0.892554450625E+03 0.94663E-02 -0.10564E-01 1944 0.263E-01 0.797E-01
DAV: 5 -0.892554509228E+03 -0.58603E-04 -0.33136E-02 1960 0.329E-01 0.623E-01
DAV: 6 -0.892549243767E+03 0.52655E-02 -0.50100E-02 1832 0.254E-01 0.366E-01
DAV: 7 -0.892548676587E+03 0.56718E-03 -0.10803E-02 1872 0.131E-01 0.176E-01
DAV: 8 -0.892548594244E+03 0.82343E-04 -0.29802E-03 1872 0.772E-02 0.981E-02
DAV: 9 -0.892548523089E+03 0.71155E-04 -0.45962E-04 1760 0.333E-02 0.445E-02
DAV: 10 -0.892548535866E+03 -0.12777E-04 -0.25498E-04 1896 0.243E-02 0.373E-02
DAV: 11 -0.892548538262E+03 -0.23954E-05 -0.62137E-05 1416 0.114E-02
15 F= -.89254854E+03 E0= -.89256264E+03 d E =-.508234E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.892643762974E+03 -0.95227E-01 -0.73194E+01 1536 0.149E+01 0.191E+00
DAV: 2 -0.892859063486E+03 -0.21530E+00 -0.23819E+00 1680 0.233E+00 0.122E+00
DAV: 3 -0.892849079051E+03 0.99844E-02 -0.16900E-01 1944 0.425E-01 0.900E-01
DAV: 4 -0.892842625499E+03 0.64536E-02 -0.64284E-02 1936 0.212E-01 0.651E-01
DAV: 5 -0.892840751487E+03 0.18740E-02 -0.45048E-02 1848 0.251E-01 0.390E-01
DAV: 6 -0.892840124074E+03 0.62741E-03 -0.13710E-02 1864 0.147E-01 0.142E-01
DAV: 7 -0.892840238165E+03 -0.11409E-03 -0.20457E-03 1800 0.673E-02 0.897E-02
DAV: 8 -0.892840319189E+03 -0.81023E-04 -0.14518E-03 2008 0.461E-02 0.921E-02
DAV: 9 -0.892840251419E+03 0.67770E-04 -0.93136E-04 2000 0.271E-02 0.516E-02
DAV: 10 -0.892840258652E+03 -0.72328E-05 -0.30261E-04 1784 0.225E-02 0.174E-02
DAV: 11 -0.892840265368E+03 -0.67164E-05 -0.49329E-05 1160 0.850E-03
16 F= -.89284027E+03 E0= -.89285457E+03 d E =-.291727E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.892598913899E+03 0.24134E+00 -0.14640E+02 1536 0.210E+01 0.271E+00
DAV: 2 -0.893026600912E+03 -0.42769E+00 -0.47643E+00 1680 0.330E+00 0.163E+00
DAV: 3 -0.893002489197E+03 0.24112E-01 -0.17420E-01 1944 0.577E-01 0.110E+00
DAV: 4 -0.892998552336E+03 0.39369E-02 -0.10308E-01 1928 0.318E-01 0.865E-01
DAV: 5 -0.892991073629E+03 0.74787E-02 -0.63215E-02 1856 0.319E-01 0.246E-01
DAV: 6 -0.892992907962E+03 -0.18343E-02 -0.17240E-02 1784 0.176E-01 0.171E-01
DAV: 7 -0.892992806290E+03 0.10167E-03 -0.17175E-03 1816 0.590E-02 0.113E-01
DAV: 8 -0.892992760701E+03 0.45589E-04 -0.41949E-04 1888 0.410E-02 0.812E-02
DAV: 9 -0.892992793850E+03 -0.33149E-04 -0.76566E-04 1896 0.331E-02 0.641E-02
DAV: 10 -0.892992772692E+03 0.21158E-04 -0.36059E-04 1784 0.208E-02 0.150E-02
DAV: 11 -0.892992802508E+03 -0.29817E-04 -0.31500E-05 1208 0.753E-03 0.685E-03
DAV: 12 -0.892992818029E+03 -0.15521E-04 -0.51487E-06 1032 0.370E-03 0.486E-03
DAV: 13 -0.892992834863E+03 -0.16834E-04 -0.35571E-06 1048 0.285E-03 0.299E-03
DAV: 14 -0.892992844289E+03 -0.94257E-05 -0.15560E-06 1000 0.196E-03
17 F= -.89299284E+03 E0= -.89300756E+03 d E =-.444306E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.893104074396E+03 -0.11124E+00 -0.38318E+01 1536 0.108E+01 0.148E+00
DAV: 2 -0.893219697488E+03 -0.11562E+00 -0.12721E+00 1632 0.172E+00 0.775E-01
DAV: 3 -0.893214096364E+03 0.56011E-02 -0.29105E-02 1952 0.285E-01 0.544E-01
DAV: 4 -0.893214664038E+03 -0.56767E-03 -0.39377E-02 2000 0.189E-01 0.524E-01
DAV: 5 -0.893210854385E+03 0.38097E-02 -0.17603E-02 1984 0.178E-01 0.891E-02
DAV: 6 -0.893211753121E+03 -0.89874E-03 -0.44998E-03 1832 0.925E-02 0.124E-01
DAV: 7 -0.893211621328E+03 0.13179E-03 -0.41467E-04 1840 0.284E-02 0.633E-02
DAV: 8 -0.893211626094E+03 -0.47660E-05 -0.17826E-04 1384 0.156E-02 0.394E-02
DAV: 9 -0.893211641036E+03 -0.14942E-04 -0.56656E-05 1552 0.123E-02 0.176E-02
DAV: 10 -0.893211655452E+03 -0.14416E-04 -0.26823E-05 1392 0.881E-03 0.872E-03
DAV: 11 -0.893211666875E+03 -0.11423E-04 -0.90452E-06 944 0.555E-03 0.521E-03
DAV: 12 -0.893211676769E+03 -0.98934E-05 -0.24200E-06 1008 0.250E-03
18 F= -.89321168E+03 E0= -.89322655E+03 d E =-.218832E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.892584884708E+03 0.62678E+00 -0.34286E+02 1536 0.322E+01 0.465E+00
DAV: 2 -0.893688131318E+03 -0.11032E+01 -0.12103E+01 1664 0.525E+00 0.241E+00
DAV: 3 -0.893622107964E+03 0.66023E-01 -0.21047E-01 1888 0.841E-01 0.160E+00
DAV: 4 -0.893599704993E+03 0.22403E-01 -0.26955E-01 1816 0.851E-01 0.599E-01
DAV: 5 -0.893600003562E+03 -0.29857E-03 -0.72397E-02 1832 0.436E-01 0.413E-01
DAV: 6 -0.893597696009E+03 0.23076E-02 -0.19374E-02 1872 0.196E-01 0.191E-01
DAV: 7 -0.893597271712E+03 0.42430E-03 -0.58948E-03 2120 0.110E-01 0.130E-01
DAV: 8 -0.893597035354E+03 0.23636E-03 -0.93278E-04 1824 0.489E-02 0.909E-02
DAV: 9 -0.893596711498E+03 0.32386E-03 -0.62878E-04 1904 0.452E-02 0.458E-02
DAV: 10 -0.893596511336E+03 0.20016E-03 -0.26925E-04 1880 0.299E-02 0.280E-02
DAV: 11 -0.893596497854E+03 0.13482E-04 -0.25664E-04 1760 0.234E-02 0.204E-02
DAV: 12 -0.893596504771E+03 -0.69169E-05 -0.53325E-05 1456 0.104E-02
19 F= -.89359650E+03 E0= -.89360689E+03 d E =-.603660E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.893468076287E+03 0.12842E+00 -0.57992E+01 1552 0.133E+01 0.185E+00
DAV: 2 -0.893643209761E+03 -0.17513E+00 -0.19345E+00 1680 0.212E+00 0.951E-01
DAV: 3 -0.893633441379E+03 0.97684E-02 -0.32730E-02 1872 0.339E-01 0.630E-01
DAV: 4 -0.893629952940E+03 0.34884E-02 -0.30626E-02 1816 0.316E-01 0.140E-01
DAV: 5 -0.893631182380E+03 -0.12294E-02 -0.12552E-02 1776 0.172E-01 0.998E-02
DAV: 6 -0.893631231760E+03 -0.49379E-04 -0.58285E-04 1920 0.409E-02 0.647E-02
DAV: 7 -0.893631229916E+03 0.18438E-05 -0.10780E-04 1688 0.203E-02 0.399E-02
DAV: 8 -0.893631258516E+03 -0.28600E-04 -0.76729E-05 1672 0.162E-02 0.126E-02
DAV: 9 -0.893631279031E+03 -0.20515E-04 -0.16782E-05 1280 0.784E-03 0.664E-03
DAV: 10 -0.893631301645E+03 -0.22615E-04 -0.12115E-05 1176 0.663E-03 0.505E-03
DAV: 11 -0.893631322043E+03 -0.20397E-04 -0.50866E-06 1120 0.423E-03 0.490E-03
DAV: 12 -0.893631341358E+03 -0.19315E-04 -0.34421E-06 1136 0.401E-03 0.339E-03
DAV: 13 -0.893631356559E+03 -0.15202E-04 -0.65661E-06 1136 0.489E-03 0.293E-03
DAV: 14 -0.893631359860E+03 -0.33007E-05 -0.18712E-06 1040 0.265E-03
20 F= -.89363136E+03 E0= -.89364176E+03 d E =-.638516E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.893671080919E+03 -0.39724E-01 -0.93275E+01 1544 0.169E+01 0.235E+00
DAV: 2 -0.893949913741E+03 -0.27883E+00 -0.30701E+00 1704 0.268E+00 0.126E+00
DAV: 3 -0.893931746351E+03 0.18167E-01 -0.51719E-02 1840 0.413E-01 0.841E-01
DAV: 4 -0.893919184444E+03 0.12562E-01 -0.71516E-02 1952 0.510E-01 0.231E-01
DAV: 5 -0.893920322186E+03 -0.11377E-02 -0.31387E-02 1800 0.264E-01 0.174E-01
DAV: 6 -0.893919481662E+03 0.84052E-03 -0.17842E-03 1920 0.653E-02 0.111E-01
DAV: 7 -0.893918416673E+03 0.10650E-02 -0.62179E-04 1864 0.437E-02 0.568E-02
DAV: 8 -0.893917533374E+03 0.88330E-03 -0.31931E-04 1880 0.356E-02 0.254E-02
DAV: 9 -0.893917161119E+03 0.37225E-03 -0.24948E-04 1920 0.295E-02 0.209E-02
DAV: 10 -0.893916773401E+03 0.38772E-03 -0.21713E-04 1992 0.311E-02 0.160E-02
DAV: 11 -0.893916740598E+03 0.32803E-04 -0.19699E-04 1768 0.196E-02 0.118E-02
DAV: 12 -0.893916785612E+03 -0.45014E-04 -0.63610E-05 1480 0.106E-02 0.806E-03
DAV: 13 -0.893916814956E+03 -0.29344E-04 -0.11217E-05 1328 0.447E-03 0.554E-03
DAV: 14 -0.893916856844E+03 -0.41888E-04 -0.76063E-06 1256 0.471E-03 0.300E-03
DAV: 15 -0.893916885283E+03 -0.28440E-04 -0.43293E-06 1168 0.290E-03 0.259E-03
DAV: 16 -0.893916896440E+03 -0.11156E-04 -0.20605E-06 1112 0.239E-03 0.158E-03
DAV: 17 -0.893916901119E+03 -0.46795E-05 -0.10257E-06 1016 0.153E-03
21 F= -.89391690E+03 E0= -.89392157E+03 d E =-.285541E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.893466270381E+03 0.45063E+00 -0.22083E+02 1536 0.259E+01 0.369E+00
DAV: 2 -0.894150779980E+03 -0.68451E+00 -0.75087E+00 1696 0.417E+00 0.199E+00
DAV: 3 -0.894111532293E+03 0.39248E-01 -0.12260E-01 1864 0.638E-01 0.131E+00
DAV: 4 -0.894100561378E+03 0.10971E-01 -0.14823E-01 1832 0.646E-01 0.346E-01
DAV: 5 -0.894103658365E+03 -0.30970E-02 -0.48913E-02 1768 0.352E-01 0.199E-01
DAV: 6 -0.894104078250E+03 -0.41988E-03 -0.28255E-03 1872 0.817E-02 0.120E-01
DAV: 7 -0.894103976251E+03 0.10200E-03 -0.35069E-04 1800 0.414E-02 0.736E-02
DAV: 8 -0.894103970442E+03 0.58091E-05 -0.32910E-04 1808 0.328E-02 0.239E-02
DAV: 9 -0.894103994284E+03 -0.23842E-04 -0.88843E-05 1776 0.170E-02 0.127E-02
DAV: 10 -0.894104031084E+03 -0.36799E-04 -0.40280E-05 1616 0.118E-02 0.991E-03
DAV: 11 -0.894104062296E+03 -0.31212E-04 -0.82265E-06 1256 0.673E-03 0.706E-03
DAV: 12 -0.894104109370E+03 -0.47075E-04 -0.25306E-05 1472 0.975E-03 0.444E-03
DAV: 13 -0.894104124255E+03 -0.14884E-04 -0.11422E-05 1352 0.451E-03 0.432E-03
DAV: 14 -0.894104135200E+03 -0.10946E-04 -0.17650E-06 1080 0.256E-03 0.255E-03
DAV: 15 -0.894104162214E+03 -0.27013E-04 -0.58088E-06 1144 0.479E-03 0.311E-03
DAV: 16 -0.894104171475E+03 -0.92613E-05 -0.20213E-06 1112 0.228E-03
22 F= -.89410417E+03 E0= -.89410844E+03 d E =-.472812E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.894201790877E+03 -0.97629E-01 -0.43673E+01 1536 0.115E+01 0.169E+00
DAV: 2 -0.894329334450E+03 -0.12754E+00 -0.14725E+00 1824 0.184E+00 0.974E-01
DAV: 3 -0.894323455228E+03 0.58792E-02 -0.42600E-02 1840 0.361E-01 0.628E-01
DAV: 4 -0.894322627925E+03 0.82730E-03 -0.16225E-02 1864 0.241E-01 0.197E-01
DAV: 5 -0.894323490256E+03 -0.86233E-03 -0.67120E-03 1784 0.129E-01 0.101E-01
DAV: 6 -0.894323516613E+03 -0.26357E-04 -0.11841E-03 1976 0.639E-02 0.626E-02
DAV: 7 -0.894323504092E+03 0.12521E-04 -0.28500E-04 1792 0.270E-02 0.420E-02
DAV: 8 -0.894323490891E+03 0.13201E-04 -0.72555E-05 1680 0.159E-02 0.192E-02
DAV: 9 -0.894323496940E+03 -0.60494E-05 -0.47656E-05 1608 0.124E-02
23 F= -.89432350E+03 E0= -.89432773E+03 d E =-.219325E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.894317835910E+03 0.56550E-02 -0.11949E+01 1536 0.601E+00 0.885E-01
DAV: 2 -0.894352362588E+03 -0.34527E-01 -0.40045E-01 1808 0.965E-01 0.508E-01
DAV: 3 -0.894350805097E+03 0.15575E-02 -0.11629E-02 1848 0.190E-01 0.328E-01
DAV: 4 -0.894350641684E+03 0.16341E-03 -0.49182E-03 1872 0.134E-01 0.104E-01
DAV: 5 -0.894350851891E+03 -0.21021E-03 -0.17746E-03 1760 0.685E-02 0.535E-02
DAV: 6 -0.894350873178E+03 -0.21288E-04 -0.38415E-04 1936 0.341E-02 0.322E-02
DAV: 7 -0.894350871411E+03 0.17679E-05 -0.66443E-05 1584 0.138E-02
24 F= -.89435087E+03 E0= -.89435509E+03 d E =-.246700E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.894401380560E+03 -0.50507E-01 -0.31590E+01 1536 0.980E+00 0.145E+00
DAV: 2 -0.894498676164E+03 -0.97296E-01 -0.11128E+00 1744 0.160E+00 0.802E-01
DAV: 3 -0.894494058500E+03 0.46177E-02 -0.22147E-02 1864 0.279E-01 0.530E-01
DAV: 4 -0.894493114014E+03 0.94449E-03 -0.14862E-02 1808 0.219E-01 0.119E-01
DAV: 5 -0.894493900416E+03 -0.78640E-03 -0.60312E-03 1832 0.117E-01 0.810E-02
DAV: 6 -0.894493892297E+03 0.81197E-05 -0.32870E-04 1808 0.304E-02 0.515E-02
DAV: 7 -0.894493879061E+03 0.13236E-04 -0.65643E-05 1624 0.173E-02 0.303E-02
DAV: 8 -0.894493888005E+03 -0.89440E-05 -0.50787E-05 1704 0.135E-02
25 F= -.89449389E+03 E0= -.89449818E+03 d E =-.143017E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.894449151372E+03 0.44728E-01 -0.28528E+01 1536 0.933E+00 0.136E+00
DAV: 2 -0.894536654356E+03 -0.87503E-01 -0.10007E+00 1760 0.152E+00 0.763E-01
DAV: 3 -0.894532487748E+03 0.41666E-02 -0.19747E-02 1888 0.264E-01 0.504E-01
DAV: 4 -0.894531612984E+03 0.87476E-03 -0.13530E-02 1816 0.209E-01 0.114E-01
DAV: 5 -0.894532314714E+03 -0.70173E-03 -0.53611E-03 1832 0.111E-01 0.762E-02
DAV: 6 -0.894532314781E+03 -0.67404E-07 -0.33635E-04 1792 0.308E-02 0.477E-02
DAV: 7 -0.894532305163E+03 0.96184E-05 -0.57203E-05 1552 0.166E-02
26 F= -.89453231E+03 E0= -.89453669E+03 d E =-.181434E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.894622147208E+03 -0.89832E-01 -0.22867E+01 1536 0.838E+00 0.129E+00
DAV: 2 -0.894686359278E+03 -0.64212E-01 -0.72552E-01 1760 0.129E+00 0.701E-01
DAV: 3 -0.894683360851E+03 0.29984E-02 -0.14085E-02 1912 0.222E-01 0.442E-01
DAV: 4 -0.894683435747E+03 -0.74895E-04 -0.12743E-02 1840 0.197E-01 0.912E-02
DAV: 5 -0.894683923249E+03 -0.48750E-03 -0.48193E-03 1768 0.107E-01 0.661E-02
DAV: 6 -0.894683923530E+03 -0.28065E-06 -0.16631E-04 1816 0.252E-02 0.445E-02
DAV: 7 -0.894683927598E+03 -0.40686E-05 -0.10245E-04 1688 0.184E-02 0.247E-02
DAV: 8 -0.894683933964E+03 -0.63658E-05 -0.28879E-05 1440 0.107E-02
27 F= -.89468393E+03 E0= -.89468847E+03 d E =-.151629E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.894450477701E+03 0.23345E+00 -0.13750E+02 1536 0.205E+01 0.322E+00
DAV: 2 -0.894854311650E+03 -0.40383E+00 -0.45385E+00 1776 0.321E+00 0.175E+00
DAV: 3 -0.894832695015E+03 0.21617E-01 -0.90475E-02 1920 0.556E-01 0.112E+00
DAV: 4 -0.894831947608E+03 0.74741E-03 -0.99403E-02 1840 0.513E-01 0.302E-01
DAV: 5 -0.894833684397E+03 -0.17368E-02 -0.29286E-02 1832 0.278E-01 0.181E-01
DAV: 6 -0.894833927929E+03 -0.24353E-03 -0.30885E-03 1776 0.900E-02 0.991E-02
DAV: 7 -0.894833944913E+03 -0.16984E-04 -0.37444E-04 1808 0.367E-02 0.582E-02
DAV: 8 -0.894834012723E+03 -0.67810E-04 -0.27115E-04 1800 0.310E-02 0.166E-02
DAV: 9 -0.894834048767E+03 -0.36044E-04 -0.53271E-05 1616 0.122E-02 0.120E-02
DAV: 10 -0.894834077380E+03 -0.28614E-04 -0.24987E-05 1392 0.101E-02 0.740E-03
DAV: 11 -0.894834099113E+03 -0.21733E-04 -0.11028E-05 1168 0.652E-03 0.733E-03
DAV: 12 -0.894834117124E+03 -0.18011E-04 -0.76629E-06 1168 0.569E-03 0.588E-03
DAV: 13 -0.894834129777E+03 -0.12653E-04 -0.11937E-05 1240 0.697E-03 0.406E-03
DAV: 14 -0.894834132316E+03 -0.25395E-05 -0.33495E-06 1064 0.322E-03
28 F= -.89483413E+03 E0= -.89483914E+03 d E =-.301827E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.894924426334E+03 -0.90297E-01 -0.13693E+01 1536 0.645E+00 0.103E+00
DAV: 2 -0.894963150913E+03 -0.38725E-01 -0.44066E-01 1760 0.989E-01 0.571E-01
DAV: 3 -0.894961099475E+03 0.20514E-02 -0.12454E-02 1904 0.206E-01 0.347E-01
DAV: 4 -0.894961118206E+03 -0.18731E-04 -0.57046E-03 1840 0.134E-01 0.950E-02
DAV: 5 -0.894961473194E+03 -0.35499E-03 -0.26453E-03 1864 0.816E-02 0.523E-02
DAV: 6 -0.894961462891E+03 0.10303E-04 -0.15548E-04 1744 0.255E-02 0.348E-02
DAV: 7 -0.894961468651E+03 -0.57600E-05 -0.10970E-04 1688 0.168E-02 0.231E-02
DAV: 8 -0.894961467559E+03 0.10915E-05 -0.23153E-05 1320 0.107E-02
29 F= -.89496147E+03 E0= -.89496657E+03 d E =-.127335E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.894863312428E+03 0.98156E-01 -0.75830E+01 1536 0.152E+01 0.246E+00
DAV: 2 -0.895084998378E+03 -0.22169E+00 -0.25008E+00 1760 0.235E+00 0.135E+00
DAV: 3 -0.895072506461E+03 0.12492E-01 -0.65180E-02 1896 0.461E-01 0.829E-01
DAV: 4 -0.895072248222E+03 0.25824E-03 -0.38296E-02 1840 0.327E-01 0.231E-01
DAV: 5 -0.895073816736E+03 -0.15685E-02 -0.14434E-02 1896 0.197E-01 0.124E-01
DAV: 6 -0.895073892143E+03 -0.75407E-04 -0.12369E-03 1776 0.634E-02 0.781E-02
DAV: 7 -0.895073908885E+03 -0.16742E-04 -0.34685E-04 1824 0.304E-02 0.507E-02
DAV: 8 -0.895073917089E+03 -0.82041E-05 -0.11955E-04 1736 0.227E-02 0.151E-02
DAV: 9 -0.895073937431E+03 -0.20342E-04 -0.53753E-05 1560 0.118E-02 0.866E-03
DAV: 10 -0.895073948969E+03 -0.11538E-04 -0.85726E-06 1120 0.611E-03 0.580E-03
DAV: 11 -0.895073963634E+03 -0.14665E-04 -0.61940E-06 1080 0.450E-03 0.435E-03
DAV: 12 -0.895073977253E+03 -0.13619E-04 -0.35011E-06 1168 0.365E-03 0.297E-03
DAV: 13 -0.895073987236E+03 -0.99835E-05 -0.42687E-06 1128 0.406E-03
30 F= -.89507399E+03 E0= -.89507930E+03 d E =-.239855E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.895155753083E+03 -0.81776E-01 -0.10308E+01 1536 0.561E+00 0.910E-01
DAV: 2 -0.895187049031E+03 -0.31296E-01 -0.34596E-01 1696 0.884E-01 0.498E-01
DAV: 3 -0.895185749224E+03 0.12998E-02 -0.65107E-03 1888 0.152E-01 0.309E-01
DAV: 4 -0.895186008587E+03 -0.25936E-03 -0.70073E-03 1824 0.144E-01 0.759E-02
DAV: 5 -0.895186139895E+03 -0.13131E-03 -0.24227E-03 1760 0.795E-02 0.497E-02
DAV: 6 -0.895186151763E+03 -0.11868E-04 -0.23869E-04 1784 0.261E-02 0.314E-02
DAV: 7 -0.895186151445E+03 0.31859E-06 -0.41793E-05 1512 0.128E-02
31 F= -.89518615E+03 E0= -.89519138E+03 d E =-.112164E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.895067593782E+03 0.11856E+00 -0.93271E+01 1536 0.169E+01 0.279E+00
DAV: 2 -0.895366620676E+03 -0.29903E+00 -0.32907E+00 1680 0.272E+00 0.151E+00
DAV: 3 -0.895353054509E+03 0.13566E-01 -0.62665E-02 1888 0.468E-01 0.953E-01
DAV: 4 -0.895355034263E+03 -0.19798E-02 -0.78206E-02 1848 0.457E-01 0.285E-01
DAV: 5 -0.895355581679E+03 -0.54742E-03 -0.22244E-02 1848 0.244E-01 0.171E-01
DAV: 6 -0.895355776801E+03 -0.19512E-03 -0.36792E-03 1776 0.957E-02 0.893E-02
DAV: 7 -0.895355783694E+03 -0.68935E-05 -0.38900E-04 1888 0.388E-02 0.572E-02
DAV: 8 -0.895355839575E+03 -0.55880E-04 -0.33156E-04 1752 0.335E-02 0.303E-02
DAV: 9 -0.895355852079E+03 -0.12505E-04 -0.53212E-05 1560 0.163E-02 0.194E-02
DAV: 10 -0.895355874973E+03 -0.22894E-04 -0.10218E-04 1656 0.180E-02 0.967E-03
DAV: 11 -0.895355881937E+03 -0.69640E-05 -0.10869E-05 1088 0.676E-03
32 F= -.89535588E+03 E0= -.89536091E+03 d E =-.281895E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.895462214545E+03 -0.10634E+00 -0.14962E+01 1536 0.679E+00 0.110E+00
DAV: 2 -0.895512962861E+03 -0.50748E-01 -0.55890E-01 1784 0.113E+00 0.622E-01
DAV: 3 -0.895511508143E+03 0.14547E-02 -0.12652E-02 1864 0.218E-01 0.388E-01
DAV: 4 -0.895511839908E+03 -0.33176E-03 -0.74154E-03 1832 0.148E-01 0.983E-02
DAV: 5 -0.895512155683E+03 -0.31578E-03 -0.26358E-03 1856 0.808E-02 0.575E-02
DAV: 6 -0.895512166836E+03 -0.11153E-04 -0.14332E-04 1736 0.223E-02 0.362E-02
DAV: 7 -0.895512174912E+03 -0.80761E-05 -0.65287E-05 1656 0.154E-02
33 F= -.89551217E+03 E0= -.89551707E+03 d E =-.156293E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.895448758911E+03 0.63408E-01 -0.51365E+01 1536 0.126E+01 0.204E+00
DAV: 2 -0.895627332447E+03 -0.17857E+00 -0.19669E+00 1784 0.212E+00 0.115E+00
DAV: 3 -0.895622072545E+03 0.52599E-02 -0.43817E-02 1864 0.403E-01 0.724E-01
DAV: 4 -0.895623057563E+03 -0.98502E-03 -0.28293E-02 1816 0.286E-01 0.196E-01
DAV: 5 -0.895624003327E+03 -0.94576E-03 -0.91525E-03 1856 0.155E-01 0.113E-01
DAV: 6 -0.895624085056E+03 -0.81729E-04 -0.87116E-04 1712 0.502E-02 0.671E-02
DAV: 7 -0.895624122503E+03 -0.37446E-04 -0.18611E-04 1792 0.267E-02 0.406E-02
DAV: 8 -0.895624181221E+03 -0.58719E-04 -0.10113E-04 1696 0.187E-02 0.137E-02
DAV: 9 -0.895624212475E+03 -0.31254E-04 -0.27899E-05 1448 0.965E-03 0.684E-03
DAV: 10 -0.895624236582E+03 -0.24106E-04 -0.10713E-05 1136 0.592E-03 0.420E-03
DAV: 11 -0.895624254886E+03 -0.18304E-04 -0.33651E-06 1144 0.291E-03 0.321E-03
DAV: 12 -0.895624276881E+03 -0.21995E-04 -0.32951E-06 1176 0.297E-03 0.218E-03
DAV: 13 -0.895624288337E+03 -0.11456E-04 -0.24304E-06 1136 0.255E-03 0.220E-03
DAV: 14 -0.895624291680E+03 -0.33425E-05 -0.68499E-07 1088 0.164E-03
34 F= -.89562429E+03 E0= -.89562898E+03 d E =-.268410E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.895692820638E+03 -0.68532E-01 -0.21436E+01 1536 0.813E+00 0.133E+00
DAV: 2 -0.895763566140E+03 -0.70746E-01 -0.77548E-01 1800 0.135E+00 0.722E-01
DAV: 3 -0.895762758784E+03 0.80736E-03 -0.14562E-02 1880 0.230E-01 0.443E-01
DAV: 4 -0.895763831613E+03 -0.10728E-02 -0.10589E-02 1816 0.175E-01 0.111E-01
DAV: 5 -0.895764055061E+03 -0.22345E-03 -0.33269E-03 1752 0.917E-02 0.696E-02
DAV: 6 -0.895764088308E+03 -0.33247E-04 -0.27648E-04 1744 0.270E-02 0.400E-02
DAV: 7 -0.895764107531E+03 -0.19223E-04 -0.66055E-05 1664 0.174E-02 0.235E-02
DAV: 8 -0.895764135237E+03 -0.27705E-04 -0.36565E-05 1464 0.114E-02 0.845E-03
DAV: 9 -0.895764149250E+03 -0.14013E-04 -0.10998E-05 1176 0.610E-03 0.451E-03
DAV: 10 -0.895764160811E+03 -0.11562E-04 -0.51379E-06 1120 0.411E-03 0.273E-03
DAV: 11 -0.895764168668E+03 -0.78569E-05 -0.16104E-06 1112 0.209E-03
35 F= -.89576417E+03 E0= -.89576878E+03 d E =-.139877E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.895576655446E+03 0.18751E+00 -0.83349E+01 1536 0.160E+01 0.263E+00
DAV: 2 -0.895861348993E+03 -0.28469E+00 -0.31226E+00 1816 0.270E+00 0.141E+00
DAV: 3 -0.895857664213E+03 0.36848E-02 -0.54820E-02 1888 0.442E-01 0.880E-01
DAV: 4 -0.895861794684E+03 -0.41305E-02 -0.50713E-02 1792 0.381E-01 0.249E-01
DAV: 5 -0.895862269224E+03 -0.47454E-03 -0.13956E-02 1792 0.192E-01 0.166E-01
DAV: 6 -0.895862400848E+03 -0.13162E-03 -0.25037E-03 1712 0.761E-02 0.833E-02
DAV: 7 -0.895862479069E+03 -0.78221E-04 -0.25317E-04 1800 0.358E-02 0.466E-02
DAV: 8 -0.895862606721E+03 -0.12765E-03 -0.21838E-04 1736 0.259E-02 0.169E-02
DAV: 9 -0.895862654990E+03 -0.48268E-04 -0.37607E-05 1592 0.116E-02 0.104E-02
DAV: 10 -0.895862702027E+03 -0.47038E-04 -0.29528E-05 1472 0.895E-03 0.639E-03
DAV: 11 -0.895862731962E+03 -0.29934E-04 -0.48540E-06 1176 0.423E-03 0.511E-03
DAV: 12 -0.895862772306E+03 -0.40345E-04 -0.98957E-06 1216 0.510E-03 0.432E-03
DAV: 13 -0.895862785656E+03 -0.13349E-04 -0.32746E-06 1176 0.325E-03 0.284E-03
DAV: 14 -0.895862796990E+03 -0.11334E-04 -0.24831E-06 1168 0.259E-03 0.175E-03
DAV: 15 -0.895862811565E+03 -0.14575E-04 -0.33520E-06 1192 0.329E-03 0.248E-03
DAV: 16 -0.895862815046E+03 -0.34808E-05 -0.11770E-06 1088 0.180E-03
36 F= -.89586282E+03 E0= -.89586728E+03 d E =-.238523E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.895956476520E+03 -0.93665E-01 -0.12075E+01 1536 0.611E+00 0.994E-01
DAV: 2 -0.895996321327E+03 -0.39845E-01 -0.43204E-01 1792 0.102E+00 0.529E-01
DAV: 3 -0.895996072901E+03 0.24843E-03 -0.71146E-03 1896 0.161E-01 0.324E-01
DAV: 4 -0.895996879639E+03 -0.80674E-03 -0.74843E-03 1768 0.146E-01 0.932E-02
DAV: 5 -0.895996898384E+03 -0.18745E-04 -0.19417E-03 1752 0.731E-02 0.654E-02
DAV: 6 -0.895996914296E+03 -0.15912E-04 -0.49811E-04 1776 0.331E-02 0.310E-02
DAV: 7 -0.895996921278E+03 -0.69817E-05 -0.33892E-05 1424 0.136E-02
37 F= -.89599692E+03 E0= -.89600139E+03 d E =-.134106E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.895877107540E+03 0.11981E+00 -0.11006E+02 1536 0.184E+01 0.305E+00
DAV: 2 -0.896260482414E+03 -0.38337E+00 -0.41857E+00 1752 0.316E+00 0.160E+00
DAV: 3 -0.896257248456E+03 0.32340E-02 -0.71709E-02 1904 0.505E-01 0.100E+00
DAV: 4 -0.896264504036E+03 -0.72556E-02 -0.88296E-02 1776 0.501E-01 0.353E-01
DAV: 5 -0.896264228756E+03 0.27528E-03 -0.19850E-02 1824 0.235E-01 0.259E-01
DAV: 6 -0.896264081199E+03 0.14756E-03 -0.72736E-03 1752 0.129E-01 0.102E-01
DAV: 7 -0.896264217878E+03 -0.13668E-03 -0.44238E-04 1736 0.419E-02 0.520E-02
DAV: 8 -0.896264379682E+03 -0.16180E-03 -0.26202E-04 1784 0.275E-02 0.152E-02
DAV: 9 -0.896264458351E+03 -0.78670E-04 -0.47492E-05 1536 0.110E-02 0.942E-03
DAV: 10 -0.896264503562E+03 -0.45210E-04 -0.10042E-05 1192 0.725E-03 0.505E-03
DAV: 11 -0.896264543060E+03 -0.39498E-04 -0.17468E-05 1240 0.631E-03 0.621E-03
DAV: 12 -0.896264550065E+03 -0.70051E-05 -0.29983E-06 1184 0.503E-03
38 F= -.89626455E+03 E0= -.89626900E+03 d E =-.401735E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.894329465299E+03 0.19351E+01 -0.45036E+02 1536 0.373E+01 0.640E+00
DAV: 2 -0.896040772239E+03 -0.17113E+01 -0.19074E+01 1752 0.671E+00 0.323E+00
DAV: 3 -0.896020737137E+03 0.20035E-01 -0.36854E-01 1912 0.111E+00 0.211E+00
DAV: 4 -0.896045707467E+03 -0.24970E-01 -0.48353E-01 1752 0.119E+00 0.910E-01
DAV: 5 -0.896043484171E+03 0.22233E-02 -0.94716E-02 1856 0.521E-01 0.687E-01
DAV: 6 -0.896040586108E+03 0.28981E-02 -0.41624E-02 1784 0.312E-01 0.262E-01
DAV: 7 -0.896041152226E+03 -0.56612E-03 -0.45989E-03 1784 0.109E-01 0.107E-01
DAV: 8 -0.896041834796E+03 -0.68257E-03 -0.17794E-03 1920 0.685E-02 0.542E-02
DAV: 9 -0.896042148707E+03 -0.31391E-03 -0.34286E-04 1784 0.342E-02 0.294E-02
DAV: 10 -0.896042296054E+03 -0.14735E-03 -0.10235E-04 1832 0.170E-02 0.151E-02
DAV: 11 -0.896042485624E+03 -0.18957E-03 -0.80134E-05 1728 0.157E-02 0.106E-02
DAV: 12 -0.896042551755E+03 -0.66131E-04 -0.16984E-05 1376 0.866E-03 0.891E-03
DAV: 13 -0.896042600542E+03 -0.48787E-04 -0.46301E-05 1576 0.131E-02 0.124E-02
DAV: 14 -0.896042611883E+03 -0.11341E-04 -0.10441E-05 1248 0.661E-03 0.915E-03
DAV: 15 -0.896042622671E+03 -0.10788E-04 -0.23437E-05 1432 0.837E-03 0.445E-03
DAV: 16 -0.896042627020E+03 -0.43491E-05 -0.67099E-06 1176 0.471E-03
39 F= -.89604263E+03 E0= -.89604704E+03 d E =-.179812E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.895468044248E+03 0.57458E+00 -0.23974E+02 1536 0.272E+01 0.427E+00
DAV: 2 -0.896319902361E+03 -0.85186E+00 -0.90294E+00 1744 0.464E+00 0.230E+00
DAV: 3 -0.896305508662E+03 0.14394E-01 -0.17011E-01 1944 0.807E-01 0.139E+00
DAV: 4 -0.896310707829E+03 -0.51992E-02 -0.74769E-02 1800 0.500E-01 0.342E-01
DAV: 5 -0.896315278397E+03 -0.45706E-02 -0.28236E-02 1744 0.258E-01 0.210E-01
DAV: 6 -0.896315315395E+03 -0.36997E-04 -0.23297E-03 1856 0.871E-02 0.119E-01
DAV: 7 -0.896315384822E+03 -0.69428E-04 -0.57449E-04 1864 0.490E-02 0.662E-02
DAV: 8 -0.896315534688E+03 -0.14987E-03 -0.47690E-04 1784 0.420E-02 0.262E-02
DAV: 9 -0.896315578015E+03 -0.43328E-04 -0.12099E-04 1800 0.220E-02 0.149E-02
DAV: 10 -0.896315620624E+03 -0.42608E-04 -0.66560E-05 1688 0.125E-02 0.121E-02
DAV: 11 -0.896315646330E+03 -0.25706E-04 -0.70095E-06 1152 0.618E-03 0.733E-03
DAV: 12 -0.896315677924E+03 -0.31594E-04 -0.31279E-05 1464 0.108E-02 0.903E-03
DAV: 13 -0.896315680549E+03 -0.26256E-05 -0.79381E-06 1160 0.509E-03
40 F= -.89631568E+03 E0= -.89632012E+03 d E =-.452866E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.896486740484E+03 -0.17106E+00 -0.25758E+01 1536 0.880E+00 0.153E+00
DAV: 2 -0.896580057010E+03 -0.93317E-01 -0.98805E-01 1800 0.153E+00 0.857E-01
DAV: 3 -0.896578962823E+03 0.10942E-02 -0.27036E-02 1920 0.322E-01 0.507E-01
DAV: 4 -0.896581229568E+03 -0.22667E-02 -0.16858E-02 1760 0.205E-01 0.187E-01
DAV: 5 -0.896581326449E+03 -0.96881E-04 -0.43712E-03 2032 0.123E-01 0.814E-02
DAV: 6 -0.896581497094E+03 -0.17064E-03 -0.79370E-04 1680 0.427E-02 0.413E-02
DAV: 7 -0.896581541135E+03 -0.44041E-04 -0.88610E-05 1792 0.199E-02 0.269E-02
DAV: 8 -0.896581603156E+03 -0.62021E-04 -0.64106E-05 1664 0.151E-02 0.139E-02
DAV: 9 -0.896581623837E+03 -0.20681E-04 -0.16556E-05 1272 0.846E-03 0.833E-03
DAV: 10 -0.896581641391E+03 -0.17555E-04 -0.25012E-05 1376 0.849E-03 0.523E-03
DAV: 11 -0.896581648337E+03 -0.69456E-05 -0.25138E-06 1120 0.351E-03
41 F= -.89658165E+03 E0= -.89658618E+03 d E =-.265968E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.896493611912E+03 0.88029E-01 -0.63252E+01 1536 0.138E+01 0.240E+00
DAV: 2 -0.896731838579E+03 -0.23823E+00 -0.25273E+00 1800 0.244E+00 0.134E+00
DAV: 3 -0.896729065028E+03 0.27736E-02 -0.67133E-02 1928 0.500E-01 0.803E-01
DAV: 4 -0.896734231781E+03 -0.51668E-02 -0.43307E-02 1784 0.335E-01 0.299E-01
DAV: 5 -0.896734532269E+03 -0.30049E-03 -0.96809E-03 2040 0.183E-01 0.135E-01
DAV: 6 -0.896735013315E+03 -0.48105E-03 -0.23899E-03 1680 0.718E-02 0.667E-02
DAV: 7 -0.896735142569E+03 -0.12925E-03 -0.17633E-04 1832 0.286E-02 0.418E-02
DAV: 8 -0.896735311669E+03 -0.16910E-03 -0.15650E-04 1736 0.236E-02 0.204E-02
DAV: 9 -0.896735370151E+03 -0.58482E-04 -0.36894E-05 1616 0.119E-02 0.118E-02
DAV: 10 -0.896735416533E+03 -0.46382E-04 -0.38388E-05 1528 0.105E-02 0.645E-03
DAV: 11 -0.896735443310E+03 -0.26777E-04 -0.38103E-06 1168 0.410E-03 0.484E-03
DAV: 12 -0.896735475730E+03 -0.32420E-04 -0.10128E-05 1216 0.638E-03 0.312E-03
DAV: 13 -0.896735486079E+03 -0.10349E-04 -0.46758E-06 1176 0.376E-03 0.315E-03
DAV: 14 -0.896735490172E+03 -0.40929E-05 -0.23356E-06 1096 0.317E-03
42 F= -.89673549E+03 E0= -.89674015E+03 d E =-.419810E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.896912333719E+03 -0.17685E+00 -0.29288E+01 1536 0.925E+00 0.166E+00
DAV: 2 -0.897013893879E+03 -0.10156E+00 -0.10504E+00 1792 0.162E+00 0.916E-01
DAV: 3 -0.897015770068E+03 -0.18762E-02 -0.25223E-02 1864 0.298E-01 0.525E-01
DAV: 4 -0.897019650645E+03 -0.38806E-02 -0.18385E-02 1768 0.211E-01 0.200E-01
DAV: 5 -0.897019396966E+03 0.25368E-03 -0.47611E-03 2016 0.132E-01 0.886E-02
DAV: 6 -0.897019623724E+03 -0.22676E-03 -0.10411E-03 1648 0.478E-02 0.406E-02
DAV: 7 -0.897019701601E+03 -0.77876E-04 -0.82222E-05 1728 0.171E-02 0.239E-02
DAV: 8 -0.897019795537E+03 -0.93936E-04 -0.56220E-05 1696 0.141E-02 0.103E-02
DAV: 9 -0.897019830305E+03 -0.34769E-04 -0.11986E-05 1224 0.698E-03 0.677E-03
DAV: 10 -0.897019869528E+03 -0.39223E-04 -0.17222E-05 1328 0.747E-03 0.434E-03
DAV: 11 -0.897019888008E+03 -0.18480E-04 -0.28221E-06 1160 0.331E-03 0.337E-03
DAV: 12 -0.897019911758E+03 -0.23749E-04 -0.59644E-06 1208 0.465E-03 0.173E-03
DAV: 13 -0.897019924239E+03 -0.12481E-04 -0.27971E-06 1176 0.244E-03 0.219E-03
DAV: 14 -0.897019930309E+03 -0.60700E-05 -0.13172E-06 1144 0.249E-03
43 F= -.89701993E+03 E0= -.89702472E+03 d E =-.284440E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.896737269016E+03 0.28266E+00 -0.14953E+02 1536 0.209E+01 0.375E+00
DAV: 2 -0.897281280231E+03 -0.54401E+00 -0.56707E+00 1800 0.375E+00 0.201E+00
DAV: 3 -0.897294552220E+03 -0.13272E-01 -0.12100E-01 1896 0.627E-01 0.119E+00
DAV: 4 -0.897315111075E+03 -0.20559E-01 -0.11008E-01 1760 0.538E-01 0.466E-01
DAV: 5 -0.897313297377E+03 0.18137E-02 -0.19710E-02 1920 0.262E-01 0.266E-01
DAV: 6 -0.897314134073E+03 -0.83670E-03 -0.10724E-02 1680 0.152E-01 0.103E-01
DAV: 7 -0.897314596629E+03 -0.46256E-03 -0.58260E-04 1712 0.474E-02 0.543E-02
DAV: 8 -0.897315082312E+03 -0.48568E-03 -0.38591E-04 1712 0.347E-02 0.210E-02
DAV: 9 -0.897315293898E+03 -0.21159E-03 -0.64463E-05 1776 0.140E-02 0.151E-02
DAV: 10 -0.897315475289E+03 -0.18139E-03 -0.63586E-05 1616 0.143E-02 0.837E-03
DAV: 11 -0.897315563511E+03 -0.88222E-04 -0.17488E-05 1352 0.648E-03 0.809E-03
DAV: 12 -0.897315651363E+03 -0.87853E-04 -0.23127E-05 1432 0.820E-03 0.641E-03
DAV: 13 -0.897315709126E+03 -0.57762E-04 -0.16745E-05 1344 0.655E-03 0.559E-03
DAV: 14 -0.897315731338E+03 -0.22212E-04 -0.65244E-06 1240 0.525E-03 0.290E-03
DAV: 15 -0.897315757337E+03 -0.25999E-04 -0.12686E-05 1312 0.640E-03 0.618E-03
DAV: 16 -0.897315764389E+03 -0.70522E-05 -0.28413E-06 1152 0.416E-03
44 F= -.89731576E+03 E0= -.89732068E+03 d E =-.580274E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.897466717145E+03 -0.15096E+00 -0.60852E+01 1536 0.134E+01 0.235E+00
DAV: 2 -0.897689857790E+03 -0.22314E+00 -0.23149E+00 1784 0.240E+00 0.127E+00
DAV: 3 -0.897696037398E+03 -0.61796E-02 -0.53988E-02 1912 0.468E-01 0.747E-01
DAV: 4 -0.897703158439E+03 -0.71210E-02 -0.30949E-02 1848 0.320E-01 0.268E-01
DAV: 5 -0.897703435709E+03 -0.27727E-03 -0.69878E-03 1864 0.160E-01 0.129E-01
DAV: 6 -0.897703817576E+03 -0.38187E-03 -0.25687E-03 1696 0.745E-02 0.629E-02
DAV: 7 -0.897703998896E+03 -0.18132E-03 -0.23148E-04 1976 0.363E-02 0.354E-02
DAV: 8 -0.897704269415E+03 -0.27052E-03 -0.23051E-04 1760 0.261E-02 0.237E-02
DAV: 9 -0.897704351896E+03 -0.82481E-04 -0.40332E-05 1624 0.143E-02 0.147E-02
DAV: 10 -0.897704450159E+03 -0.98264E-04 -0.10249E-04 1744 0.173E-02 0.128E-02
DAV: 11 -0.897704498094E+03 -0.47935E-04 -0.10306E-05 1256 0.749E-03 0.102E-02
DAV: 12 -0.897704554543E+03 -0.56449E-04 -0.33597E-05 1504 0.115E-02 0.535E-03
DAV: 13 -0.897704584903E+03 -0.30361E-04 -0.11249E-05 1256 0.642E-03 0.480E-03
DAV: 14 -0.897704605994E+03 -0.21091E-04 -0.98834E-06 1232 0.577E-03 0.367E-03
DAV: 15 -0.897704614619E+03 -0.86247E-05 -0.40052E-06 1120 0.366E-03
45 F= -.89770461E+03 E0= -.89770942E+03 d E =-.388850E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.897607450215E+03 0.97156E-01 -0.56425E+01 1536 0.129E+01 0.226E+00
DAV: 2 -0.897815106487E+03 -0.20766E+00 -0.21737E+00 1792 0.233E+00 0.122E+00
DAV: 3 -0.897821392459E+03 -0.62860E-02 -0.57102E-02 1880 0.461E-01 0.720E-01
DAV: 4 -0.897827258328E+03 -0.58659E-02 -0.25070E-02 1880 0.302E-01 0.265E-01
DAV: 5 -0.897827942598E+03 -0.68427E-03 -0.66508E-03 1864 0.148E-01 0.123E-01
DAV: 6 -0.897828186039E+03 -0.24344E-03 -0.20291E-03 1744 0.704E-02 0.612E-02
DAV: 7 -0.897828372018E+03 -0.18598E-03 -0.26117E-04 1800 0.333E-02 0.341E-02
DAV: 8 -0.897828592895E+03 -0.22088E-03 -0.14410E-04 1784 0.221E-02 0.167E-02
DAV: 9 -0.897828695109E+03 -0.10221E-03 -0.54341E-05 1704 0.137E-02 0.104E-02
DAV: 10 -0.897828788442E+03 -0.93333E-04 -0.38662E-05 1632 0.109E-02 0.808E-03
DAV: 11 -0.897828845424E+03 -0.56982E-04 -0.90301E-06 1256 0.622E-03 0.636E-03
DAV: 12 -0.897828912563E+03 -0.67139E-04 -0.34371E-05 1536 0.113E-02 0.585E-03
DAV: 13 -0.897828927578E+03 -0.15015E-04 -0.11954E-05 1296 0.596E-03 0.643E-03
DAV: 14 -0.897828937052E+03 -0.94743E-05 -0.87416E-06 1120 0.587E-03
46 F= -.89782894E+03 E0= -.89783359E+03 d E =-.513173E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.897987877612E+03 -0.15895E+00 -0.27763E+01 1536 0.898E+00 0.161E+00
DAV: 2 -0.898080680260E+03 -0.92803E-01 -0.94646E-01 1768 0.154E+00 0.805E-01
DAV: 3 -0.898085750705E+03 -0.50704E-02 -0.14973E-02 1880 0.245E-01 0.462E-01
DAV: 4 -0.898089014878E+03 -0.32642E-02 -0.11765E-02 1840 0.220E-01 0.136E-01
DAV: 5 -0.898089099074E+03 -0.84196E-04 -0.30259E-03 1824 0.100E-01 0.966E-02
DAV: 6 -0.898089184741E+03 -0.85667E-04 -0.14384E-03 1768 0.570E-02 0.431E-02
DAV: 7 -0.898089293082E+03 -0.10834E-03 -0.10401E-04 1848 0.216E-02 0.232E-02
DAV: 8 -0.898089430123E+03 -0.13704E-03 -0.95105E-05 1736 0.170E-02 0.144E-02
DAV: 9 -0.898089492104E+03 -0.61981E-04 -0.28693E-05 1432 0.104E-02 0.952E-03
DAV: 10 -0.898089551492E+03 -0.59387E-04 -0.57920E-05 1736 0.133E-02 0.125E-02
DAV: 11 -0.898089581232E+03 -0.29741E-04 -0.10823E-05 1264 0.770E-03 0.856E-03
DAV: 12 -0.898089606077E+03 -0.24845E-04 -0.24228E-05 1496 0.890E-03 0.339E-03
DAV: 13 -0.898089621107E+03 -0.15030E-04 -0.54215E-06 1184 0.459E-03 0.227E-03
DAV: 14 -0.898089629646E+03 -0.85393E-05 -0.37340E-06 1176 0.274E-03
47 F= -.89808963E+03 E0= -.89809435E+03 d E =-.260693E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.897409323080E+03 0.68030E+00 -0.24403E+02 1536 0.266E+01 0.481E+00
DAV: 2 -0.898241075920E+03 -0.83175E+00 -0.86847E+00 1784 0.463E+00 0.242E+00
DAV: 3 -0.898283283530E+03 -0.42208E-01 -0.19202E-01 1864 0.792E-01 0.141E+00
DAV: 4 -0.898306221579E+03 -0.22938E-01 -0.86825E-02 1920 0.679E-01 0.459E-01
DAV: 5 -0.898304832588E+03 0.13890E-02 -0.39761E-02 1896 0.341E-01 0.320E-01
DAV: 6 -0.898303287624E+03 0.15450E-02 -0.12083E-02 1856 0.181E-01 0.157E-01
DAV: 7 -0.898303584711E+03 -0.29709E-03 -0.24696E-03 1880 0.850E-02 0.857E-02
DAV: 8 -0.898304200631E+03 -0.61592E-03 -0.13530E-03 1736 0.593E-02 0.944E-02
DAV: 9 -0.898304347174E+03 -0.14654E-03 -0.42295E-04 1920 0.342E-02 0.520E-02
DAV: 10 -0.898304893564E+03 -0.54639E-03 -0.41150E-04 2048 0.379E-02 0.380E-02
DAV: 11 -0.898305234694E+03 -0.34113E-03 -0.11450E-04 1792 0.163E-02 0.282E-02
DAV: 12 -0.898305640346E+03 -0.40565E-03 -0.14547E-04 1816 0.225E-02 0.128E-02
DAV: 13 -0.898305869744E+03 -0.22940E-03 -0.16264E-04 1944 0.197E-02 0.176E-02
DAV: 14 -0.898305947851E+03 -0.78107E-04 -0.18760E-05 1392 0.956E-03 0.111E-02
DAV: 15 -0.898306021520E+03 -0.73670E-04 -0.54030E-05 1656 0.128E-02 0.943E-03
DAV: 16 -0.898306048410E+03 -0.26890E-04 -0.75079E-06 1112 0.527E-03 0.795E-03
DAV: 17 -0.898306114203E+03 -0.65793E-04 -0.21442E-05 1376 0.813E-03 0.418E-03
DAV: 18 -0.898306126857E+03 -0.12654E-04 -0.51699E-06 1080 0.365E-03 0.390E-03
DAV: 19 -0.898306149728E+03 -0.22871E-04 -0.38613E-06 1136 0.281E-03 0.291E-03
DAV: 20 -0.898306162573E+03 -0.12845E-04 -0.23648E-06 1096 0.374E-03 0.138E-03
DAV: 21 -0.898306168439E+03 -0.58654E-05 -0.35488E-06 1016 0.297E-03
48 F= -.89830617E+03 E0= -.89831528E+03 d E =-.477231E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.898250288200E+03 0.55874E-01 -0.27203E+01 1536 0.890E+00 0.159E+00
DAV: 2 -0.898337824866E+03 -0.87537E-01 -0.90963E-01 1752 0.153E+00 0.806E-01
DAV: 3 -0.898343266510E+03 -0.54416E-02 -0.26856E-02 1856 0.281E-01 0.455E-01
DAV: 4 -0.898346157869E+03 -0.28914E-02 -0.79123E-03 1864 0.170E-01 0.173E-01
DAV: 5 -0.898346622666E+03 -0.46480E-03 -0.25693E-03 1992 0.942E-02 0.905E-02
DAV: 6 -0.898346603481E+03 0.19184E-04 -0.81846E-04 1904 0.581E-02 0.552E-02
DAV: 7 -0.898346612727E+03 -0.92461E-05 -0.33901E-04 1768 0.287E-02 0.301E-02
DAV: 8 -0.898346658054E+03 -0.45326E-04 -0.86731E-05 1632 0.170E-02 0.136E-02
DAV: 9 -0.898346700726E+03 -0.42672E-04 -0.24742E-05 1344 0.829E-03 0.771E-03
DAV: 10 -0.898346732719E+03 -0.31993E-04 -0.73497E-06 1080 0.540E-03 0.518E-03
DAV: 11 -0.898346771629E+03 -0.38910E-04 -0.10402E-05 1160 0.550E-03 0.393E-03
DAV: 12 -0.898346790029E+03 -0.18399E-04 -0.24532E-06 1104 0.279E-03 0.319E-03
DAV: 13 -0.898346805444E+03 -0.15416E-04 -0.36482E-06 1136 0.414E-03 0.179E-03
DAV: 14 -0.898346814747E+03 -0.93028E-05 -0.21837E-06 1096 0.242E-03
49 F= -.89834681E+03 E0= -.89835649E+03 d E =-.517878E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.898679727554E+03 -0.33292E+00 -0.24661E+01 1544 0.863E+00 0.148E+00
DAV: 2 -0.898779557597E+03 -0.99830E-01 -0.10626E+00 1816 0.156E+00 0.862E-01
DAV: 3 -0.898778379356E+03 0.11782E-02 -0.38533E-02 1896 0.371E-01 0.530E-01
DAV: 4 -0.898779619927E+03 -0.12406E-02 -0.91886E-03 1816 0.172E-01 0.260E-01
DAV: 5 -0.898780119780E+03 -0.49985E-03 -0.47951E-03 1840 0.122E-01 0.131E-01
DAV: 6 -0.898780057381E+03 0.62399E-04 -0.12090E-03 1840 0.686E-02 0.538E-02
DAV: 7 -0.898780168906E+03 -0.11152E-03 -0.38472E-04 1696 0.349E-02 0.401E-02
DAV: 8 -0.898780263411E+03 -0.94505E-04 -0.15124E-04 1800 0.213E-02 0.259E-02
DAV: 9 -0.898780333633E+03 -0.70222E-04 -0.32941E-05 1496 0.118E-02 0.126E-02
DAV: 10 -0.898780388951E+03 -0.55318E-04 -0.40592E-05 1608 0.107E-02 0.622E-03
DAV: 11 -0.898780419445E+03 -0.30494E-04 -0.46408E-06 1112 0.371E-03 0.490E-03
DAV: 12 -0.898780474884E+03 -0.55439E-04 -0.10649E-05 1224 0.557E-03 0.329E-03
DAV: 13 -0.898780496884E+03 -0.22000E-04 -0.77619E-06 1168 0.468E-03 0.486E-03
DAV: 14 -0.898780505455E+03 -0.85707E-05 -0.25116E-06 1080 0.317E-03
50 F= -.89878051E+03 E0= -.89879005E+03 d E =-.433691E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.898773714454E+03 0.67824E-02 -0.63439E+01 1544 0.139E+01 0.237E+00
DAV: 2 -0.899032023212E+03 -0.25831E+00 -0.27454E+00 1800 0.249E+00 0.139E+00
DAV: 3 -0.899028581892E+03 0.34413E-02 -0.91568E-02 1928 0.579E-01 0.855E-01
DAV: 4 -0.899032062643E+03 -0.34808E-02 -0.28829E-02 1808 0.287E-01 0.391E-01
DAV: 5 -0.899033595284E+03 -0.15326E-02 -0.18237E-02 1848 0.192E-01 0.217E-01
DAV: 6 -0.899033415132E+03 0.18015E-03 -0.32384E-03 1832 0.106E-01 0.860E-02
DAV: 7 -0.899033721370E+03 -0.30624E-03 -0.82039E-04 1712 0.514E-02 0.623E-02
DAV: 8 -0.899034010880E+03 -0.28951E-03 -0.38956E-04 1880 0.341E-02 0.398E-02
DAV: 9 -0.899034217055E+03 -0.20617E-03 -0.87733E-05 1872 0.185E-02 0.200E-02
DAV: 10 -0.899034364736E+03 -0.14768E-03 -0.94045E-05 1832 0.160E-02 0.965E-03
DAV: 11 -0.899034461543E+03 -0.96807E-04 -0.11576E-05 1224 0.545E-03 0.687E-03
DAV: 12 -0.899034581250E+03 -0.11971E-03 -0.20031E-05 1400 0.654E-03 0.456E-03
DAV: 13 -0.899034637100E+03 -0.55850E-04 -0.12201E-05 1232 0.600E-03 0.488E-03
DAV: 14 -0.899034661208E+03 -0.24108E-04 -0.48308E-06 1136 0.390E-03 0.444E-03
DAV: 15 -0.899034679119E+03 -0.17911E-04 -0.45095E-06 1144 0.418E-03 0.269E-03
DAV: 16 -0.899034688518E+03 -0.93996E-05 -0.38098E-06 1080 0.341E-03
51 F= -.89903469E+03 E0= -.89904391E+03 d E =-.687874E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.899305047505E+03 -0.27037E+00 -0.21462E+01 1536 0.794E+00 0.146E+00
DAV: 2 -0.899387545725E+03 -0.82498E-01 -0.87415E-01 1784 0.145E+00 0.856E-01
DAV: 3 -0.899390528585E+03 -0.29829E-02 -0.24533E-02 1864 0.319E-01 0.525E-01
DAV: 4 -0.899395054455E+03 -0.45259E-02 -0.22096E-02 1840 0.241E-01 0.311E-01
DAV: 5 -0.899393778397E+03 0.12761E-02 -0.38199E-03 1880 0.103E-01 0.135E-01
DAV: 6 -0.899393745864E+03 0.32533E-04 -0.22756E-03 2192 0.107E-01 0.600E-02
DAV: 7 -0.899393843434E+03 -0.97570E-04 -0.71266E-04 1712 0.423E-02 0.344E-02
DAV: 8 -0.899393882836E+03 -0.39402E-04 -0.14848E-04 1912 0.215E-02 0.208E-02
DAV: 9 -0.899393947506E+03 -0.64670E-04 -0.60159E-05 1672 0.143E-02 0.103E-02
DAV: 10 -0.899393973434E+03 -0.25928E-04 -0.13258E-05 1160 0.673E-03 0.760E-03
DAV: 11 -0.899394004741E+03 -0.31307E-04 -0.16514E-05 1296 0.771E-03 0.409E-03
DAV: 12 -0.899394023528E+03 -0.18787E-04 -0.33583E-06 1080 0.320E-03 0.370E-03
DAV: 13 -0.899394045925E+03 -0.22397E-04 -0.30393E-06 1144 0.313E-03 0.155E-03
DAV: 14 -0.899394069712E+03 -0.23787E-04 -0.44818E-06 1168 0.307E-03 0.240E-03
DAV: 15 -0.899394078647E+03 -0.89348E-05 -0.10493E-06 1072 0.243E-03
52 F= -.89939408E+03 E0= -.89940323E+03 d E =-.359390E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.899287384194E+03 0.10669E+00 -0.96074E+01 1536 0.168E+01 0.312E+00
DAV: 2 -0.899654980660E+03 -0.36760E+00 -0.39486E+00 1808 0.306E+00 0.182E+00
DAV: 3 -0.899668879351E+03 -0.13899E-01 -0.11774E-01 1880 0.670E-01 0.113E+00
DAV: 4 -0.899687879094E+03 -0.19000E-01 -0.10435E-01 1816 0.524E-01 0.595E-01
DAV: 5 -0.899683120868E+03 0.47582E-02 -0.16108E-02 1872 0.207E-01 0.272E-01
DAV: 6 -0.899683034215E+03 0.86653E-04 -0.12211E-02 1928 0.218E-01 0.120E-01
DAV: 7 -0.899683389810E+03 -0.35560E-03 -0.25535E-03 1688 0.831E-02 0.732E-02
DAV: 8 -0.899683564645E+03 -0.17483E-03 -0.77344E-04 1832 0.466E-02 0.398E-02
DAV: 9 -0.899683823343E+03 -0.25870E-03 -0.24258E-04 1904 0.287E-02 0.212E-02
DAV: 10 -0.899683917530E+03 -0.94187E-04 -0.61213E-05 1760 0.133E-02 0.142E-02
DAV: 11 -0.899684038404E+03 -0.12087E-03 -0.45725E-05 1616 0.119E-02 0.927E-03
DAV: 12 -0.899684108109E+03 -0.69705E-04 -0.10192E-05 1280 0.531E-03 0.660E-03
DAV: 13 -0.899684185086E+03 -0.76977E-04 -0.93961E-06 1208 0.468E-03 0.514E-03
DAV: 14 -0.899684245369E+03 -0.60283E-04 -0.12846E-05 1328 0.531E-03 0.317E-03
DAV: 15 -0.899684269241E+03 -0.23872E-04 -0.39493E-06 1104 0.320E-03 0.307E-03
DAV: 16 -0.899684291832E+03 -0.22591E-04 -0.34100E-06 1160 0.312E-03 0.230E-03
DAV: 17 -0.899684302880E+03 -0.11048E-04 -0.23568E-06 1072 0.275E-03 0.236E-03
DAV: 18 -0.899684311837E+03 -0.89572E-05 -0.15075E-06 1088 0.247E-03
53 F= -.89968431E+03 E0= -.89969317E+03 d E =-.649623E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.899854717023E+03 -0.17041E+00 -0.22823E+01 1536 0.830E+00 0.143E+00
DAV: 2 -0.899931165624E+03 -0.76449E-01 -0.81515E-01 1776 0.141E+00 0.782E-01
DAV: 3 -0.899935470628E+03 -0.43050E-02 -0.17812E-02 1824 0.248E-01 0.488E-01
DAV: 4 -0.899939078787E+03 -0.36082E-02 -0.16733E-02 1816 0.231E-01 0.254E-01
DAV: 5 -0.899938427128E+03 0.65166E-03 -0.37609E-03 1840 0.939E-02 0.117E-01
DAV: 6 -0.899938316841E+03 0.11029E-03 -0.69413E-04 2120 0.608E-02 0.700E-02
DAV: 7 -0.899938393324E+03 -0.76483E-04 -0.74976E-04 1728 0.402E-02 0.291E-02
DAV: 8 -0.899938476765E+03 -0.83442E-04 -0.49289E-05 1688 0.133E-02 0.152E-02
DAV: 9 -0.899938551243E+03 -0.74478E-04 -0.37986E-05 1592 0.106E-02 0.757E-03
DAV: 10 -0.899938586497E+03 -0.35254E-04 -0.59259E-06 1168 0.478E-03 0.561E-03
DAV: 11 -0.899938643438E+03 -0.56941E-04 -0.11407E-05 1208 0.618E-03 0.303E-03
DAV: 12 -0.899938671394E+03 -0.27956E-04 -0.47975E-06 1136 0.314E-03 0.370E-03
DAV: 13 -0.899938682054E+03 -0.10661E-04 -0.13239E-06 1056 0.263E-03 0.216E-03
DAV: 14 -0.899938717530E+03 -0.35476E-04 -0.88725E-06 1184 0.518E-03 0.312E-03
DAV: 15 -0.899938721688E+03 -0.41574E-05 -0.20238E-06 1056 0.225E-03
54 F= -.89993872E+03 E0= -.89994754E+03 d E =-.254410E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.899660036671E+03 0.27868E+00 -0.16171E+02 1536 0.221E+01 0.381E+00
DAV: 2 -0.900178228848E+03 -0.51819E+00 -0.56475E+00 1792 0.369E+00 0.210E+00
DAV: 3 -0.900206743756E+03 -0.28515E-01 -0.17822E-01 1824 0.699E-01 0.132E+00
DAV: 4 -0.900228750733E+03 -0.22007E-01 -0.15470E-01 1824 0.587E-01 0.681E-01
DAV: 5 -0.900226183498E+03 0.25672E-02 -0.25968E-02 1856 0.257E-01 0.291E-01
DAV: 6 -0.900225561463E+03 0.62203E-03 -0.64925E-03 1944 0.159E-01 0.179E-01
DAV: 7 -0.900226092517E+03 -0.53105E-03 -0.55249E-03 1768 0.112E-01 0.810E-02
DAV: 8 -0.900226575974E+03 -0.48346E-03 -0.44307E-04 1800 0.381E-02 0.433E-02
DAV: 9 -0.900227087114E+03 -0.51114E-03 -0.27321E-04 1816 0.267E-02 0.180E-02
DAV: 10 -0.900227312563E+03 -0.22545E-03 -0.40739E-05 1624 0.122E-02 0.137E-02
DAV: 11 -0.900227619198E+03 -0.30664E-03 -0.75251E-05 1696 0.141E-02 0.105E-02
DAV: 12 -0.900227750422E+03 -0.13122E-03 -0.14293E-05 1296 0.639E-03 0.886E-03
DAV: 13 -0.900227881730E+03 -0.13131E-03 -0.25760E-05 1416 0.955E-03 0.407E-03
DAV: 14 -0.900227975758E+03 -0.94028E-04 -0.22786E-05 1384 0.687E-03 0.573E-03
DAV: 15 -0.900227999756E+03 -0.23998E-04 -0.50259E-06 1112 0.449E-03 0.463E-03
DAV: 16 -0.900228024240E+03 -0.24484E-04 -0.68477E-06 1144 0.466E-03 0.350E-03
DAV: 17 -0.900228041711E+03 -0.17471E-04 -0.32169E-06 1088 0.283E-03 0.318E-03
DAV: 18 -0.900228050160E+03 -0.84489E-05 -0.18130E-06 1096 0.265E-03
55 F= -.90022805E+03 E0= -.90023646E+03 d E =-.543738E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.900357920288E+03 -0.12988E+00 -0.85366E+01 1552 0.163E+01 0.280E+00
DAV: 2 -0.900668817669E+03 -0.31090E+00 -0.34030E+00 1784 0.271E+00 0.136E+00
DAV: 3 -0.900657440041E+03 0.11378E-01 -0.51976E-02 1896 0.519E-01 0.868E-01
DAV: 4 -0.900657465937E+03 -0.25896E-04 -0.81229E-02 1800 0.599E-01 0.258E-01
DAV: 5 -0.900659437936E+03 -0.19720E-02 -0.28770E-02 1728 0.258E-01 0.251E-01
DAV: 6 -0.900659227164E+03 0.21077E-03 -0.38126E-03 1792 0.934E-02 0.131E-01
DAV: 7 -0.900659496757E+03 -0.26959E-03 -0.38240E-04 1776 0.324E-02 0.692E-02
DAV: 8 -0.900659898105E+03 -0.40135E-03 -0.56631E-04 1848 0.407E-02 0.256E-02
DAV: 9 -0.900660151495E+03 -0.25339E-03 -0.15435E-04 1864 0.206E-02 0.285E-02
DAV: 10 -0.900660269647E+03 -0.11815E-03 -0.27006E-05 1368 0.956E-03 0.189E-02
DAV: 11 -0.900660443200E+03 -0.17355E-03 -0.78808E-05 1824 0.174E-02 0.704E-03
DAV: 12 -0.900660545155E+03 -0.10195E-03 -0.22457E-05 1336 0.716E-03 0.686E-03
DAV: 13 -0.900660606898E+03 -0.61743E-04 -0.78266E-06 1200 0.523E-03 0.635E-03
DAV: 14 -0.900660654539E+03 -0.47641E-04 -0.18467E-05 1312 0.783E-03 0.722E-03
DAV: 15 -0.900660664426E+03 -0.98865E-05 -0.45761E-06 1072 0.457E-03
56 F= -.90066066E+03 E0= -.90066920E+03 d E =-.432614E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.900198857105E+03 0.46180E+00 -0.20302E+02 1552 0.251E+01 0.425E+00
DAV: 2 -0.900910754005E+03 -0.71190E+00 -0.79185E+00 1776 0.412E+00 0.211E+00
DAV: 3 -0.900871262616E+03 0.39491E-01 -0.11742E-01 1888 0.834E-01 0.135E+00
DAV: 4 -0.900840362026E+03 0.30901E-01 -0.24078E-01 1880 0.117E+00 0.471E-01
DAV: 5 -0.900842647324E+03 -0.22853E-02 -0.11119E-01 1728 0.510E-01 0.507E-01
DAV: 6 -0.900840134205E+03 0.25131E-02 -0.12521E-02 1920 0.172E-01 0.328E-01
DAV: 7 -0.900836350462E+03 0.37837E-02 -0.80897E-03 1800 0.153E-01 0.197E-01
DAV: 8 -0.900835053857E+03 0.12966E-02 -0.29507E-03 2000 0.127E-01 0.933E-02
DAV: 9 -0.900835041949E+03 0.11908E-04 -0.24823E-03 1808 0.836E-02 0.203E-01
DAV: 10 -0.900834735547E+03 0.30640E-03 -0.10813E-03 1872 0.492E-02 0.561E-02
DAV: 11 -0.900835211447E+03 -0.47590E-03 -0.55294E-04 1856 0.407E-02 0.822E-02
DAV: 12 -0.900835436960E+03 -0.22551E-03 -0.31307E-04 1864 0.259E-02 0.343E-02
DAV: 13 -0.900835649927E+03 -0.21297E-03 -0.15966E-04 1960 0.263E-02 0.179E-02
DAV: 14 -0.900835886898E+03 -0.23697E-03 -0.14777E-04 1736 0.181E-02 0.235E-02
DAV: 15 -0.900835925635E+03 -0.38738E-04 -0.21139E-05 1344 0.130E-02 0.119E-02
DAV: 16 -0.900836003862E+03 -0.78227E-04 -0.66947E-05 1672 0.131E-02 0.103E-02
DAV: 17 -0.900836061433E+03 -0.57570E-04 -0.10989E-05 1184 0.805E-03 0.574E-03
DAV: 18 -0.900836106164E+03 -0.44731E-04 -0.15190E-05 1184 0.551E-03 0.485E-03
DAV: 19 -0.900836124795E+03 -0.18631E-04 -0.26590E-06 1024 0.310E-03 0.209E-03
DAV: 20 -0.900836141504E+03 -0.16710E-04 -0.72865E-06 1008 0.479E-03 0.524E-03
DAV: 21 -0.900836143507E+03 -0.20029E-05 -0.13755E-06 840 0.284E-03
57 F= -.90083614E+03 E0= -.90086807E+03 d E =-.608093E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.900979492255E+03 -0.14335E+00 -0.57444E+01 1552 0.134E+01 0.214E+00
DAV: 2 -0.901177550608E+03 -0.19806E+00 -0.21889E+00 1752 0.224E+00 0.113E+00
DAV: 3 -0.901170824846E+03 0.67258E-02 -0.40974E-02 1904 0.405E-01 0.737E-01
DAV: 4 -0.901178280616E+03 -0.74558E-02 -0.41315E-02 1904 0.497E-01 0.782E-01
DAV: 5 -0.901172044874E+03 0.62357E-02 -0.29709E-02 1856 0.274E-01 0.306E-01
DAV: 6 -0.901171991252E+03 0.53621E-04 -0.48685E-03 1904 0.117E-01 0.189E-01
DAV: 7 -0.901171886611E+03 0.10464E-03 -0.29290E-03 1752 0.864E-02 0.592E-02
DAV: 8 -0.901172007172E+03 -0.12056E-03 -0.13421E-04 1712 0.220E-02 0.349E-02
DAV: 9 -0.901172148377E+03 -0.14120E-03 -0.16786E-04 1768 0.239E-02 0.152E-02
DAV: 10 -0.901172193848E+03 -0.45471E-04 -0.38142E-05 1448 0.109E-02 0.127E-02
DAV: 11 -0.901172246410E+03 -0.52562E-04 -0.30813E-05 1424 0.101E-02 0.100E-02
DAV: 12 -0.901172285505E+03 -0.39096E-04 -0.60420E-06 1088 0.578E-03 0.660E-03
DAV: 13 -0.901172336299E+03 -0.50794E-04 -0.20485E-05 1392 0.810E-03 0.391E-03
DAV: 14 -0.901172362104E+03 -0.25804E-04 -0.49831E-06 1080 0.382E-03 0.254E-03
DAV: 15 -0.901172376468E+03 -0.14365E-04 -0.23056E-06 1056 0.193E-03 0.178E-03
DAV: 16 -0.901172385166E+03 -0.86979E-05 -0.88207E-07 1000 0.137E-03
58 F= -.90117239E+03 E0= -.90120358E+03 d E =-.336242E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.901068363070E+03 0.10401E+00 -0.69660E+01 1536 0.148E+01 0.235E+00
DAV: 2 -0.901305082047E+03 -0.23672E+00 -0.26258E+00 1768 0.245E+00 0.123E+00
DAV: 3 -0.901296566365E+03 0.85157E-02 -0.47227E-02 1872 0.451E-01 0.818E-01
DAV: 4 -0.901303995914E+03 -0.74295E-02 -0.72798E-02 1800 0.495E-01 0.589E-01
DAV: 5 -0.901298307242E+03 0.56887E-02 -0.20811E-02 1832 0.241E-01 0.258E-01
DAV: 6 -0.901297994726E+03 0.31252E-03 -0.36255E-03 1944 0.119E-01 0.170E-01
DAV: 7 -0.901298056798E+03 -0.62072E-04 -0.34578E-03 1720 0.880E-02 0.572E-02
DAV: 8 -0.901298179924E+03 -0.12313E-03 -0.21248E-04 1768 0.242E-02 0.342E-02
DAV: 9 -0.901298320787E+03 -0.14086E-03 -0.11469E-04 1736 0.186E-02 0.139E-02
DAV: 10 -0.901298395435E+03 -0.74648E-04 -0.26577E-05 1384 0.107E-02 0.980E-03
DAV: 11 -0.901298463954E+03 -0.68520E-04 -0.18888E-05 1264 0.719E-03 0.606E-03
DAV: 12 -0.901298508047E+03 -0.44093E-04 -0.55322E-06 1088 0.391E-03 0.412E-03
DAV: 13 -0.901298538081E+03 -0.30035E-04 -0.33568E-06 1080 0.308E-03 0.301E-03
DAV: 14 -0.901298571821E+03 -0.33740E-04 -0.59012E-06 1112 0.367E-03 0.217E-03
DAV: 15 -0.901298582269E+03 -0.10447E-04 -0.15348E-06 1008 0.183E-03 0.183E-03
DAV: 16 -0.901298593288E+03 -0.11020E-04 -0.21995E-06 1040 0.318E-03 0.166E-03
DAV: 17 -0.901298598450E+03 -0.51617E-05 -0.10719E-06 944 0.160E-03
59 F= -.90129860E+03 E0= -.90132857E+03 d E =-.462455E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.901447014260E+03 -0.14842E+00 -0.45077E+01 1536 0.119E+01 0.180E+00
DAV: 2 -0.901598307234E+03 -0.15129E+00 -0.17011E+00 1768 0.201E+00 0.994E-01
DAV: 3 -0.901596817371E+03 0.14899E-02 -0.36766E-02 1848 0.346E-01 0.694E-01
DAV: 4 -0.901603311935E+03 -0.64946E-02 -0.40999E-02 1816 0.348E-01 0.538E-01
DAV: 5 -0.901598254639E+03 0.50573E-02 -0.10855E-02 1840 0.195E-01 0.202E-01
DAV: 6 -0.901598031078E+03 0.22356E-03 -0.23723E-03 1920 0.105E-01 0.147E-01
DAV: 7 -0.901597894619E+03 0.13646E-03 -0.31172E-03 1752 0.851E-02 0.530E-02
DAV: 8 -0.901597923233E+03 -0.28615E-04 -0.25639E-04 1792 0.265E-02 0.322E-02
DAV: 9 -0.901597934741E+03 -0.11507E-04 -0.64419E-05 1648 0.145E-02 0.159E-02
DAV: 10 -0.901597951182E+03 -0.16441E-04 -0.25479E-05 1216 0.934E-03 0.763E-03
DAV: 11 -0.901597961824E+03 -0.10642E-04 -0.98063E-06 944 0.620E-03 0.990E-03
DAV: 12 -0.901597968533E+03 -0.67088E-05 -0.50356E-06 920 0.360E-03
60 F= -.90159797E+03 E0= -.90162795E+03 d E =-.299370E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.901516522415E+03 0.81439E-01 -0.60709E+01 1536 0.138E+01 0.208E+00
DAV: 2 -0.901720459267E+03 -0.20394E+00 -0.22895E+00 1768 0.233E+00 0.117E+00
DAV: 3 -0.901718245188E+03 0.22141E-02 -0.49503E-02 1808 0.413E-01 0.846E-01
DAV: 4 -0.901727268433E+03 -0.90232E-02 -0.46798E-02 1888 0.347E-01 0.666E-01
DAV: 5 -0.901720704927E+03 0.65635E-02 -0.16012E-02 1880 0.280E-01 0.346E-01
DAV: 6 -0.901718901752E+03 0.18032E-02 -0.89901E-03 1872 0.135E-01 0.165E-01
DAV: 7 -0.901718997662E+03 -0.95910E-04 -0.24518E-03 1888 0.850E-02 0.112E-01
DAV: 8 -0.901718983592E+03 0.14071E-04 -0.67928E-04 1872 0.432E-02 0.892E-02
DAV: 9 -0.901718897951E+03 0.85641E-04 -0.26198E-04 2040 0.367E-02 0.233E-02
DAV: 10 -0.901718928843E+03 -0.30893E-04 -0.17634E-04 1680 0.201E-02 0.141E-02
DAV: 11 -0.901718943383E+03 -0.14540E-04 -0.32803E-05 1344 0.100E-02 0.110E-02
DAV: 12 -0.901718953389E+03 -0.10006E-04 -0.51715E-06 904 0.449E-03 0.878E-03
DAV: 13 -0.901718967187E+03 -0.13798E-04 -0.10876E-05 1064 0.613E-03 0.322E-03
DAV: 14 -0.901718973687E+03 -0.65006E-05 -0.25073E-06 840 0.275E-03
61 F= -.90171897E+03 E0= -.90174859E+03 d E =-.420375E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.901605972933E+03 0.11299E+00 -0.95249E+01 1544 0.173E+01 0.249E+00
DAV: 2 -0.901957798062E+03 -0.35183E+00 -0.38113E+00 1672 0.294E+00 0.131E+00
DAV: 3 -0.901937843221E+03 0.19955E-01 -0.64197E-02 1920 0.510E-01 0.877E-01
DAV: 4 -0.901939828035E+03 -0.19848E-02 -0.55830E-02 1896 0.553E-01 0.861E-01
DAV: 5 -0.901932348257E+03 0.74798E-02 -0.36613E-02 1880 0.314E-01 0.306E-01
DAV: 6 -0.901932781735E+03 -0.43348E-03 -0.74826E-03 1856 0.139E-01 0.173E-01
DAV: 7 -0.901932942991E+03 -0.16126E-03 -0.13885E-03 1776 0.640E-02 0.705E-02
DAV: 8 -0.901932975766E+03 -0.32775E-04 -0.30625E-04 1816 0.308E-02 0.413E-02
DAV: 9 -0.901933009799E+03 -0.34033E-04 -0.15104E-04 1728 0.219E-02 0.181E-02
DAV: 10 -0.901933038058E+03 -0.28259E-04 -0.30590E-05 1352 0.935E-03 0.109E-02
DAV: 11 -0.901933071745E+03 -0.33687E-04 -0.10244E-05 1064 0.712E-03 0.467E-03
DAV: 12 -0.901933100673E+03 -0.28928E-04 -0.85966E-06 1064 0.503E-03 0.407E-03
DAV: 13 -0.901933120501E+03 -0.19828E-04 -0.38324E-06 984 0.435E-03 0.271E-03
DAV: 14 -0.901933151464E+03 -0.30962E-04 -0.93533E-06 1104 0.595E-03 0.488E-03
DAV: 15 -0.901933164106E+03 -0.12642E-04 -0.34256E-06 968 0.319E-03 0.417E-03
DAV: 16 -0.901933169886E+03 -0.57806E-05 -0.33731E-06 880 0.383E-03
62 F= -.90193317E+03 E0= -.90196198E+03 d E =-.214196E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.901907613053E+03 0.25551E-01 -0.12312E+01 1544 0.622E+00 0.906E-01
DAV: 2 -0.901952277465E+03 -0.44664E-01 -0.48334E-01 1688 0.105E+00 0.461E-01
DAV: 3 -0.901949986154E+03 0.22913E-02 -0.73605E-03 1864 0.189E-01 0.330E-01
DAV: 4 -0.901951015138E+03 -0.10290E-02 -0.73097E-03 1840 0.144E-01 0.333E-01
DAV: 5 -0.901949004338E+03 0.20108E-02 -0.32163E-03 1888 0.129E-01 0.820E-02
DAV: 6 -0.901949213621E+03 -0.20928E-03 -0.19740E-03 1832 0.631E-02 0.539E-02
DAV: 7 -0.901949218079E+03 -0.44586E-05 -0.21048E-04 1776 0.236E-02 0.339E-02
DAV: 8 -0.901949223886E+03 -0.58066E-05 -0.23444E-05 1168 0.107E-02
63 F= -.90194922E+03 E0= -.90197752E+03 d E =-.230250E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.901908788681E+03 0.40429E-01 -0.79206E+01 1544 0.156E+01 0.217E+00
DAV: 2 -0.902172788978E+03 -0.26400E+00 -0.29074E+00 1664 0.257E+00 0.101E+00
DAV: 3 -0.902161791156E+03 0.10998E-01 -0.40364E-02 1856 0.393E-01 0.698E-01
DAV: 4 -0.902164174082E+03 -0.23829E-02 -0.44107E-02 1800 0.373E-01 0.590E-01
DAV: 5 -0.902157389894E+03 0.67842E-02 -0.16502E-02 1952 0.265E-01 0.211E-01
DAV: 6 -0.902157580586E+03 -0.19069E-03 -0.50259E-03 1736 0.105E-01 0.159E-01
DAV: 7 -0.902157531521E+03 0.49065E-04 -0.13195E-03 1760 0.577E-02 0.116E-01
DAV: 8 -0.902157444776E+03 0.86745E-04 -0.29273E-04 1832 0.257E-02 0.475E-02
DAV: 9 -0.902157464887E+03 -0.20111E-04 -0.22850E-04 1944 0.334E-02 0.164E-02
DAV: 10 -0.902157480159E+03 -0.15272E-04 -0.96369E-05 1680 0.165E-02 0.182E-02
DAV: 11 -0.902157482275E+03 -0.21158E-05 -0.19760E-05 960 0.749E-03
64 F= -.90215748E+03 E0= -.90218524E+03 d E =-.208258E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.901799075104E+03 0.35841E+00 -0.14514E+02 1544 0.212E+01 0.294E+00
DAV: 2 -0.902294959379E+03 -0.49588E+00 -0.54729E+00 1664 0.351E+00 0.138E+00
DAV: 3 -0.902274369337E+03 0.20590E-01 -0.75215E-02 1840 0.558E-01 0.999E-01
DAV: 4 -0.902280062481E+03 -0.56931E-02 -0.71355E-02 1808 0.440E-01 0.831E-01
DAV: 5 -0.902267334185E+03 0.12728E-01 -0.29661E-02 1936 0.413E-01 0.470E-01
DAV: 6 -0.902264931794E+03 0.24024E-02 -0.20754E-02 1856 0.211E-01 0.234E-01
DAV: 7 -0.902265182277E+03 -0.25048E-03 -0.20413E-03 1864 0.782E-02 0.211E-01
DAV: 8 -0.902264776354E+03 0.40592E-03 -0.12846E-03 1784 0.567E-02 0.984E-02
DAV: 9 -0.902264734899E+03 0.41456E-04 -0.78130E-04 2096 0.614E-02 0.260E-02
DAV: 10 -0.902264774926E+03 -0.40027E-04 -0.28937E-04 1664 0.274E-02 0.268E-02
DAV: 11 -0.902264783227E+03 -0.83007E-05 -0.46981E-05 1544 0.106E-02
65 F= -.90226478E+03 E0= -.90229181E+03 d E =-.315559E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902054934811E+03 0.20984E+00 -0.11498E+02 1536 0.189E+01 0.245E+00
DAV: 2 -0.902437209933E+03 -0.38228E+00 -0.42189E+00 1696 0.312E+00 0.122E+00
DAV: 3 -0.902425928913E+03 0.11281E-01 -0.68434E-02 1928 0.475E-01 0.889E-01
DAV: 4 -0.902430689911E+03 -0.47610E-02 -0.30043E-02 1936 0.396E-01 0.117E+00
DAV: 5 -0.902415820845E+03 0.14869E-01 -0.50142E-02 1808 0.385E-01 0.352E-01
DAV: 6 -0.902416907664E+03 -0.10868E-02 -0.12192E-02 1752 0.171E-01 0.252E-01
DAV: 7 -0.902416295601E+03 0.61206E-03 -0.28978E-03 1880 0.877E-02 0.115E-01
DAV: 8 -0.902416194371E+03 0.10123E-03 -0.43595E-04 1840 0.315E-02 0.603E-02
DAV: 9 -0.902416188522E+03 0.58484E-05 -0.21105E-04 1800 0.260E-02 0.311E-02
DAV: 10 -0.902416201242E+03 -0.12720E-04 -0.64850E-05 1696 0.150E-02 0.188E-02
DAV: 11 -0.902416219018E+03 -0.17775E-04 -0.17269E-05 1168 0.704E-03 0.110E-02
DAV: 12 -0.902416239306E+03 -0.20288E-04 -0.10674E-05 1096 0.638E-03 0.541E-03
DAV: 13 -0.902416258857E+03 -0.19551E-04 -0.94841E-06 928 0.557E-03 0.471E-03
DAV: 14 -0.902416274087E+03 -0.15230E-04 -0.34099E-06 952 0.335E-03 0.429E-03
DAV: 15 -0.902416289603E+03 -0.15517E-04 -0.33045E-06 928 0.368E-03 0.189E-03
DAV: 16 -0.902416301716E+03 -0.12113E-04 -0.23494E-06 944 0.221E-03 0.209E-03
DAV: 17 -0.902416306844E+03 -0.51279E-05 -0.81320E-07 872 0.135E-03
66 F= -.90241631E+03 E0= -.90244406E+03 d E =-.151524E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902416211442E+03 0.90275E-04 -0.56088E-02 1568 0.418E-01 0.535E-02
DAV: 2 -0.902416396384E+03 -0.18494E-03 -0.20028E-03 1680 0.681E-02 0.261E-02
DAV: 3 -0.902416391371E+03 0.50130E-05 -0.28545E-05 1208 0.102E-02
67 F= -.90241639E+03 E0= -.90244414E+03 d E =-.151608E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902397642707E+03 0.18754E-01 -0.37117E+01 1536 0.107E+01 0.132E+00
DAV: 2 -0.902511375920E+03 -0.11373E+00 -0.12549E+00 1736 0.170E+00 0.699E-01
DAV: 3 -0.902506288895E+03 0.50870E-02 -0.20108E-02 1944 0.265E-01 0.481E-01
DAV: 4 -0.902507277707E+03 -0.98881E-03 -0.12625E-02 1808 0.212E-01 0.436E-01
DAV: 5 -0.902503046342E+03 0.42314E-02 -0.83391E-03 1896 0.173E-01 0.118E-01
DAV: 6 -0.902503276938E+03 -0.23060E-03 -0.32866E-03 1856 0.875E-02 0.834E-02
DAV: 7 -0.902503288767E+03 -0.11829E-04 -0.86394E-04 1864 0.496E-02 0.509E-02
DAV: 8 -0.902503296956E+03 -0.81886E-05 -0.95893E-05 1792 0.216E-02
68 F= -.90250330E+03 E0= -.90253186E+03 d E =-.869056E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902487398414E+03 0.15890E-01 -0.10105E+01 1536 0.559E+00 0.697E-01
DAV: 2 -0.902518122006E+03 -0.30724E-01 -0.34023E-01 1744 0.888E-01 0.361E-01
DAV: 3 -0.902516812512E+03 0.13095E-02 -0.56048E-03 1920 0.140E-01 0.254E-01
DAV: 4 -0.902516991464E+03 -0.17895E-03 -0.30731E-03 1800 0.103E-01 0.240E-01
DAV: 5 -0.902515827946E+03 0.11635E-02 -0.23610E-03 1880 0.976E-02 0.507E-02
DAV: 6 -0.902515951476E+03 -0.12353E-03 -0.10418E-03 1728 0.491E-02 0.443E-02
DAV: 7 -0.902515958134E+03 -0.66581E-05 -0.20510E-04 1784 0.241E-02 0.271E-02
DAV: 8 -0.902515970135E+03 -0.12001E-04 -0.19935E-05 1120 0.852E-03 0.192E-02
DAV: 9 -0.902515989820E+03 -0.19685E-04 -0.24108E-05 1336 0.949E-03 0.846E-03
DAV: 10 -0.902516005180E+03 -0.15360E-04 -0.95999E-06 960 0.585E-03 0.497E-03
DAV: 11 -0.902516019301E+03 -0.14121E-04 -0.89928E-06 968 0.561E-03 0.352E-03
DAV: 12 -0.902516028092E+03 -0.87913E-05 -0.24680E-06 864 0.259E-03
69 F= -.90251603E+03 E0= -.90254528E+03 d E =-.996367E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902517865875E+03 -0.18466E-02 -0.91240E+00 1568 0.535E+00 0.697E-01
DAV: 2 -0.902546080882E+03 -0.28215E-01 -0.31482E-01 1792 0.869E-01 0.380E-01
DAV: 3 -0.902544584861E+03 0.14960E-02 -0.61915E-03 1888 0.144E-01 0.264E-01
DAV: 4 -0.902544744379E+03 -0.15952E-03 -0.35891E-03 1896 0.116E-01 0.256E-01
DAV: 5 -0.902543445794E+03 0.12986E-02 -0.29894E-03 1848 0.983E-02 0.621E-02
DAV: 6 -0.902543518694E+03 -0.72899E-04 -0.95441E-04 1776 0.497E-02 0.431E-02
DAV: 7 -0.902543534706E+03 -0.16012E-04 -0.23229E-04 1736 0.246E-02 0.249E-02
DAV: 8 -0.902543536003E+03 -0.12972E-05 -0.17658E-05 1080 0.860E-03
70 F= -.90254354E+03 E0= -.90257307E+03 d E =-.275079E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902543544196E+03 -0.94904E-05 -0.85909E-03 1568 0.165E-01 0.249E-02
DAV: 2 -0.902543577214E+03 -0.33017E-04 -0.33777E-04 1784 0.288E-02 0.119E-02
DAV: 3 -0.902543579292E+03 -0.20786E-05 -0.14506E-05 904 0.683E-03
71 F= -.90254358E+03 E0= -.90257312E+03 d E =-.275512E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902551314304E+03 -0.77371E-02 -0.34213E+00 1568 0.327E+00 0.441E-01
DAV: 2 -0.902561225273E+03 -0.99110E-02 -0.11346E-01 1776 0.517E-01 0.233E-01
DAV: 3 -0.902560715601E+03 0.50967E-03 -0.22335E-03 1888 0.915E-02 0.170E-01
DAV: 4 -0.902560865622E+03 -0.15002E-03 -0.18589E-03 1832 0.696E-02 0.174E-01
DAV: 5 -0.902560389105E+03 0.47652E-03 -0.89483E-04 1920 0.683E-02 0.444E-02
DAV: 6 -0.902560415909E+03 -0.26804E-04 -0.36588E-04 1768 0.323E-02 0.344E-02
DAV: 7 -0.902560407868E+03 0.80411E-05 -0.20597E-04 1728 0.240E-02 0.152E-02
DAV: 8 -0.902560409313E+03 -0.14458E-05 -0.20560E-05 992 0.816E-03
72 F= -.90256041E+03 E0= -.90259006E+03 d E =-.168300E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902560421730E+03 -0.13863E-04 -0.58198E-01 1568 0.135E+00 0.184E-01
DAV: 2 -0.902562128823E+03 -0.17071E-02 -0.19602E-02 1784 0.215E-01 0.952E-02
DAV: 3 -0.902562038866E+03 0.89956E-04 -0.38432E-04 1888 0.362E-02 0.658E-02
DAV: 4 -0.902561995001E+03 0.43865E-04 -0.35835E-04 1760 0.370E-02 0.248E-02
DAV: 5 -0.902561999573E+03 -0.45720E-05 -0.10710E-04 1600 0.166E-02 0.194E-02
DAV: 6 -0.902561998147E+03 0.14262E-05 -0.20550E-05 1184 0.980E-03
73 F= -.90256200E+03 E0= -.90259146E+03 d E =-.184189E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902570330572E+03 -0.83310E-02 -0.29698E+00 1552 0.298E+00 0.416E-01
DAV: 2 -0.902578476355E+03 -0.81458E-02 -0.93479E-02 1768 0.473E-01 0.229E-01
DAV: 3 -0.902578234877E+03 0.24148E-03 -0.29254E-03 1840 0.992E-02 0.177E-01
DAV: 4 -0.902578221444E+03 0.13433E-04 -0.14734E-03 1864 0.597E-02 0.157E-01
DAV: 5 -0.902577913126E+03 0.30832E-03 -0.91065E-04 2040 0.736E-02 0.431E-02
DAV: 6 -0.902577948816E+03 -0.35690E-04 -0.43815E-04 1776 0.336E-02 0.399E-02
DAV: 7 -0.902577930185E+03 0.18631E-04 -0.19110E-04 1760 0.247E-02 0.165E-02
DAV: 8 -0.902577931994E+03 -0.18089E-05 -0.37886E-05 1360 0.949E-03
74 F= -.90257793E+03 E0= -.90260786E+03 d E =-.159338E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902577309949E+03 0.62024E-03 -0.17979E+00 1552 0.232E+00 0.324E-01
DAV: 2 -0.902582293134E+03 -0.49832E-02 -0.57174E-02 1760 0.368E-01 0.176E-01
DAV: 3 -0.902582095902E+03 0.19723E-03 -0.16037E-03 1832 0.722E-02 0.127E-01
DAV: 4 -0.902582186109E+03 -0.90207E-04 -0.10983E-03 1808 0.511E-02 0.126E-01
DAV: 5 -0.902581958460E+03 0.22765E-03 -0.50087E-04 2008 0.504E-02 0.376E-02
DAV: 6 -0.902581969764E+03 -0.11304E-04 -0.17886E-04 1816 0.236E-02 0.298E-02
DAV: 7 -0.902581961792E+03 0.79724E-05 -0.11905E-04 1672 0.188E-02 0.133E-02
DAV: 8 -0.902581962835E+03 -0.10429E-05 -0.16907E-05 952 0.657E-03
75 F= -.90258196E+03 E0= -.90261205E+03 d E =-.199647E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902590599078E+03 -0.86373E-02 -0.14457E+00 1552 0.209E+00 0.327E-01
DAV: 2 -0.902595133551E+03 -0.45345E-02 -0.48669E-02 1808 0.343E-01 0.188E-01
DAV: 3 -0.902595032282E+03 0.10127E-03 -0.20211E-03 1880 0.916E-02 0.165E-01
DAV: 4 -0.902594660985E+03 0.37130E-03 -0.81138E-04 1776 0.484E-02 0.874E-02
DAV: 5 -0.902594622914E+03 0.38070E-04 -0.65073E-04 1856 0.538E-02 0.289E-02
DAV: 6 -0.902594638016E+03 -0.15102E-04 -0.26439E-04 1648 0.242E-02 0.245E-02
DAV: 7 -0.902594633378E+03 0.46379E-05 -0.31681E-05 1256 0.109E-02
76 F= -.90259463E+03 E0= -.90262491E+03 d E =-.126705E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902592826304E+03 0.18117E-02 -0.45996E+00 1544 0.372E+00 0.585E-01
DAV: 2 -0.902607062492E+03 -0.14236E-01 -0.15451E-01 1808 0.610E-01 0.323E-01
DAV: 3 -0.902606676849E+03 0.38564E-03 -0.57917E-03 1872 0.155E-01 0.268E-01
DAV: 4 -0.902605727872E+03 0.94898E-03 -0.24491E-03 1784 0.833E-02 0.153E-01
DAV: 5 -0.902605596460E+03 0.13141E-03 -0.19240E-03 1856 0.935E-02 0.510E-02
DAV: 6 -0.902605635511E+03 -0.39051E-04 -0.79118E-04 1704 0.424E-02 0.432E-02
DAV: 7 -0.902605621370E+03 0.14141E-04 -0.10948E-04 1736 0.197E-02 0.267E-02
DAV: 8 -0.902605619576E+03 0.17944E-05 -0.57163E-05 1472 0.123E-02
77 F= -.90260562E+03 E0= -.90263640E+03 d E =-.236567E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902616905663E+03 -0.11284E-01 -0.94150E-01 1560 0.158E+00 0.269E-01
DAV: 2 -0.902619538153E+03 -0.26325E-02 -0.29640E-02 1832 0.257E-01 0.150E-01
DAV: 3 -0.902619404765E+03 0.13339E-03 -0.87783E-04 1944 0.501E-02 0.984E-02
DAV: 4 -0.902619472927E+03 -0.68162E-04 -0.61678E-04 2000 0.528E-02 0.776E-02
DAV: 5 -0.902619382064E+03 0.90863E-04 -0.42150E-04 1864 0.332E-02 0.341E-02
DAV: 6 -0.902619376010E+03 0.60534E-05 -0.84153E-05 1648 0.162E-02
78 F= -.90261938E+03 E0= -.90264990E+03 d E =-.137564E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902620823050E+03 -0.14410E-02 -0.38700E+00 1544 0.321E+00 0.547E-01
DAV: 2 -0.902631605951E+03 -0.10783E-01 -0.12122E-01 1808 0.519E-01 0.310E-01
DAV: 3 -0.902631175748E+03 0.43020E-03 -0.39635E-03 1952 0.107E-01 0.225E-01
DAV: 4 -0.902631413234E+03 -0.23749E-03 -0.24346E-03 1936 0.965E-02 0.212E-01
DAV: 5 -0.902630772990E+03 0.64024E-03 -0.21017E-03 1816 0.768E-02 0.595E-02
DAV: 6 -0.902630781218E+03 -0.82279E-05 -0.50683E-04 1912 0.403E-02 0.418E-02
DAV: 7 -0.902630783178E+03 -0.19599E-05 -0.26679E-04 1680 0.273E-02 0.206E-02
DAV: 8 -0.902630780417E+03 0.27609E-05 -0.28712E-05 1128 0.979E-03
79 F= -.90263078E+03 E0= -.90266075E+03 d E =-.251608E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902638134893E+03 -0.73517E-02 -0.52476E-01 1552 0.118E+00 0.187E-01
DAV: 2 -0.902639470179E+03 -0.13353E-02 -0.14778E-02 1784 0.183E-01 0.116E-01
DAV: 3 -0.902639462369E+03 0.78101E-05 -0.63550E-04 1928 0.408E-02 0.919E-02
DAV: 4 -0.902639424487E+03 0.37882E-04 -0.23166E-04 1888 0.323E-02 0.690E-02
DAV: 5 -0.902639388399E+03 0.36088E-04 -0.21590E-04 1832 0.271E-02 0.153E-02
DAV: 6 -0.902639394969E+03 -0.65709E-05 -0.58560E-05 1464 0.131E-02
80 F= -.90263939E+03 E0= -.90266930E+03 d E =-.861455E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902645615879E+03 -0.62275E-02 -0.36819E+00 1544 0.311E+00 0.495E-01
DAV: 2 -0.902655001716E+03 -0.93858E-02 -0.10308E-01 1776 0.481E-01 0.307E-01
DAV: 3 -0.902654897877E+03 0.10384E-03 -0.43246E-03 1912 0.105E-01 0.250E-01
DAV: 4 -0.902654589748E+03 0.30813E-03 -0.16998E-03 1904 0.858E-02 0.183E-01
DAV: 5 -0.902654277170E+03 0.31258E-03 -0.15653E-03 1800 0.720E-02 0.394E-02
DAV: 6 -0.902654303390E+03 -0.26221E-04 -0.41864E-04 1840 0.356E-02 0.328E-02
DAV: 7 -0.902654302922E+03 0.46800E-06 -0.14015E-04 1672 0.206E-02 0.162E-02
DAV: 8 -0.902654305382E+03 -0.24593E-05 -0.18843E-05 976 0.797E-03
81 F= -.90265431E+03 E0= -.90268392E+03 d E =-.235250E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902616107554E+03 0.38195E-01 -0.14718E+01 1544 0.620E+00 0.991E-01
DAV: 2 -0.902654332876E+03 -0.38225E-01 -0.41299E-01 1760 0.963E-01 0.649E-01
DAV: 3 -0.902653543001E+03 0.78987E-03 -0.20296E-02 1904 0.226E-01 0.553E-01
DAV: 4 -0.902651574425E+03 0.19686E-02 -0.71068E-03 1920 0.177E-01 0.368E-01
DAV: 5 -0.902650386267E+03 0.11882E-02 -0.65420E-03 1800 0.148E-01 0.761E-02
DAV: 6 -0.902650500993E+03 -0.11473E-03 -0.17643E-03 1816 0.713E-02 0.651E-02
DAV: 7 -0.902650491965E+03 0.90281E-05 -0.51792E-04 1832 0.399E-02 0.324E-02
DAV: 8 -0.902650500067E+03 -0.81023E-05 -0.81838E-05 1624 0.159E-02
82 F= -.90265050E+03 E0= -.90267943E+03 d E =-.197197E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902646367580E+03 0.41244E-02 -0.50637E+00 1544 0.365E+00 0.576E-01
DAV: 2 -0.902659150169E+03 -0.12783E-01 -0.14060E-01 1760 0.561E-01 0.363E-01
DAV: 3 -0.902659074628E+03 0.75541E-04 -0.58985E-03 1928 0.125E-01 0.287E-01
DAV: 4 -0.902658478636E+03 0.59599E-03 -0.23258E-03 1888 0.101E-01 0.205E-01
DAV: 5 -0.902658210095E+03 0.26854E-03 -0.20707E-03 1808 0.824E-02 0.514E-02
DAV: 6 -0.902658228105E+03 -0.18010E-04 -0.52548E-04 1760 0.396E-02 0.349E-02
DAV: 7 -0.902658225534E+03 0.25708E-05 -0.15747E-04 1784 0.214E-02 0.180E-02
DAV: 8 -0.902658223543E+03 0.19911E-05 -0.16727E-05 960 0.833E-03
83 F= -.90265822E+03 E0= -.90268763E+03 d E =-.274431E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902666325618E+03 -0.81001E-02 -0.17515E+00 1544 0.220E+00 0.369E-01
DAV: 2 -0.902671650776E+03 -0.53252E-02 -0.56425E-02 1840 0.360E-01 0.250E-01
DAV: 3 -0.902671507603E+03 0.14317E-03 -0.31296E-03 1944 0.110E-01 0.212E-01
DAV: 4 -0.902670887321E+03 0.62028E-03 -0.12719E-03 1808 0.581E-02 0.112E-01
DAV: 5 -0.902670902228E+03 -0.14906E-04 -0.88713E-04 1760 0.507E-02 0.454E-02
DAV: 6 -0.902670893945E+03 0.82824E-05 -0.26027E-04 1632 0.237E-02 0.241E-02
DAV: 7 -0.902670892356E+03 0.15894E-05 -0.56006E-05 1320 0.135E-02
84 F= -.90267089E+03 E0= -.90270046E+03 d E =-.126688E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902670919552E+03 -0.25607E-04 -0.12768E+00 1544 0.188E+00 0.318E-01
DAV: 2 -0.902674863171E+03 -0.39436E-02 -0.41759E-02 1840 0.309E-01 0.212E-01
DAV: 3 -0.902674754687E+03 0.10848E-03 -0.22914E-03 1944 0.945E-02 0.179E-01
DAV: 4 -0.902674321585E+03 0.43310E-03 -0.93433E-04 1816 0.503E-02 0.957E-02
DAV: 5 -0.902674330787E+03 -0.92025E-05 -0.61823E-04 1760 0.429E-02 0.359E-02
DAV: 6 -0.902674329268E+03 0.15188E-05 -0.18031E-04 1600 0.199E-02 0.197E-02
DAV: 7 -0.902674328742E+03 0.52664E-06 -0.38815E-05 1272 0.113E-02
85 F= -.90267433E+03 E0= -.90270406E+03 d E =-.161052E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902678151625E+03 -0.38224E-02 -0.50080E-01 1536 0.122E+00 0.202E-01
DAV: 2 -0.902679811226E+03 -0.16596E-02 -0.18220E-02 1800 0.210E-01 0.116E-01
DAV: 3 -0.902679797950E+03 0.13276E-04 -0.88658E-04 1896 0.574E-02 0.101E-01
DAV: 4 -0.902679675907E+03 0.12204E-03 -0.34313E-04 1808 0.312E-02 0.577E-02
DAV: 5 -0.902679657826E+03 0.18082E-04 -0.16781E-04 1856 0.294E-02 0.168E-02
DAV: 6 -0.902679664989E+03 -0.71630E-05 -0.81327E-05 1504 0.137E-02
86 F= -.90267966E+03 E0= -.90270949E+03 d E =-.533625E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902679929952E+03 -0.27213E-03 -0.55055E-01 1536 0.128E+00 0.213E-01
DAV: 2 -0.902681751604E+03 -0.18217E-02 -0.20219E-02 1808 0.221E-01 0.118E-01
DAV: 3 -0.902681730597E+03 0.21007E-04 -0.88942E-04 1928 0.581E-02 0.100E-01
DAV: 4 -0.902681627541E+03 0.10306E-03 -0.37424E-04 1808 0.320E-02 0.620E-02
DAV: 5 -0.902681601220E+03 0.26321E-04 -0.17650E-04 1888 0.314E-02 0.174E-02
DAV: 6 -0.902681609019E+03 -0.77990E-05 -0.88274E-05 1568 0.145E-02
87 F= -.90268161E+03 E0= -.90271154E+03 d E =-.728028E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902683940812E+03 -0.23396E-02 -0.81075E-01 1544 0.158E+00 0.262E-01
DAV: 2 -0.902686498717E+03 -0.25579E-02 -0.28587E-02 1720 0.257E-01 0.122E-01
DAV: 3 -0.902686349738E+03 0.14898E-03 -0.71979E-04 1920 0.475E-02 0.828E-02
DAV: 4 -0.902686388861E+03 -0.39124E-04 -0.33776E-04 2024 0.421E-02 0.846E-02
DAV: 5 -0.902686275350E+03 0.11351E-03 -0.38904E-04 1800 0.322E-02 0.224E-02
DAV: 6 -0.902686283951E+03 -0.86007E-05 -0.91175E-05 1608 0.155E-02
88 F= -.90268628E+03 E0= -.90271625E+03 d E =-.467493E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902686068527E+03 0.20682E-03 -0.42819E-01 1536 0.115E+00 0.193E-01
DAV: 2 -0.902687426501E+03 -0.13580E-02 -0.15158E-02 1720 0.187E-01 0.872E-02
DAV: 3 -0.902687348100E+03 0.78401E-04 -0.36010E-04 1896 0.343E-02 0.578E-02
DAV: 4 -0.902687374787E+03 -0.26687E-04 -0.19177E-04 1904 0.326E-02 0.601E-02
DAV: 5 -0.902687317739E+03 0.57048E-04 -0.21049E-04 1800 0.230E-02 0.181E-02
DAV: 6 -0.902687320915E+03 -0.31760E-05 -0.40951E-05 1336 0.105E-02
89 F= -.90268732E+03 E0= -.90271731E+03 d E =-.571190E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902689275855E+03 -0.19581E-02 -0.43042E-01 1536 0.114E+00 0.173E-01
DAV: 2 -0.902690602014E+03 -0.13262E-02 -0.14481E-02 1776 0.185E-01 0.104E-01
DAV: 3 -0.902690554449E+03 0.47565E-04 -0.51244E-04 1840 0.431E-02 0.830E-02
DAV: 4 -0.902690504878E+03 0.49571E-04 -0.25986E-04 1808 0.271E-02 0.581E-02
DAV: 5 -0.902690477267E+03 0.27611E-04 -0.15108E-04 1808 0.285E-02 0.141E-02
DAV: 6 -0.902690483817E+03 -0.65499E-05 -0.69986E-05 1536 0.132E-02
90 F= -.90269048E+03 E0= -.90272047E+03 d E =-.316290E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902690503330E+03 -0.26063E-04 -0.27467E-01 1552 0.910E-01 0.140E-01
DAV: 2 -0.902691362932E+03 -0.85960E-03 -0.94139E-03 1776 0.149E-01 0.826E-02
DAV: 3 -0.902691331963E+03 0.30969E-04 -0.31640E-04 1840 0.340E-02 0.656E-02
DAV: 4 -0.902691305965E+03 0.25997E-04 -0.16869E-04 1824 0.220E-02 0.476E-02
DAV: 5 -0.902691286880E+03 0.19086E-04 -0.10133E-04 1760 0.234E-02 0.118E-02
DAV: 6 -0.902691291187E+03 -0.43077E-05 -0.45641E-05 1448 0.108E-02
91 F= -.90269129E+03 E0= -.90272128E+03 d E =-.397027E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902692957662E+03 -0.16708E-02 -0.40748E-01 1536 0.109E+00 0.163E-01
DAV: 2 -0.902694089027E+03 -0.11314E-02 -0.12897E-02 1800 0.173E-01 0.921E-02
DAV: 3 -0.902694033275E+03 0.55752E-04 -0.33378E-04 1912 0.325E-02 0.626E-02
DAV: 4 -0.902694067525E+03 -0.34251E-04 -0.23575E-04 1848 0.354E-02 0.577E-02
DAV: 5 -0.902694014111E+03 0.53414E-04 -0.21268E-04 1832 0.247E-02 0.242E-02
DAV: 6 -0.902694013092E+03 0.10193E-05 -0.39949E-05 1328 0.107E-02
92 F= -.90269401E+03 E0= -.90272400E+03 d E =-.272190E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902694072070E+03 -0.57959E-04 -0.13628E-01 1552 0.630E-01 0.964E-02
DAV: 2 -0.902694464293E+03 -0.39222E-03 -0.44594E-03 1800 0.102E-01 0.537E-02
DAV: 3 -0.902694445103E+03 0.19190E-04 -0.11046E-04 1848 0.193E-02 0.362E-02
DAV: 4 -0.902694449752E+03 -0.46488E-05 -0.11337E-04 1752 0.239E-02 0.258E-02
DAV: 5 -0.902694443695E+03 0.60569E-05 -0.65377E-05 1792 0.135E-02
93 F= -.90269444E+03 E0= -.90272432E+03 d E =-.315251E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902695610148E+03 -0.11604E-02 -0.39782E-01 1552 0.108E+00 0.173E-01
DAV: 2 -0.902696782265E+03 -0.11721E-02 -0.13096E-02 1792 0.175E-01 0.900E-02
DAV: 3 -0.902696716456E+03 0.65809E-04 -0.35768E-04 1888 0.329E-02 0.585E-02
DAV: 4 -0.902696712724E+03 0.37314E-05 -0.22869E-04 1848 0.311E-02 0.393E-02
DAV: 5 -0.902696704125E+03 0.85993E-05 -0.14522E-04 1800 0.202E-02 0.249E-02
DAV: 6 -0.902696697096E+03 0.70287E-05 -0.21942E-05 1192 0.981E-03
94 F= -.90269670E+03 E0= -.90272670E+03 d E =-.225340E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902696643827E+03 0.60298E-04 -0.17080E-01 1552 0.708E-01 0.114E-01
DAV: 2 -0.902697162491E+03 -0.51866E-03 -0.57146E-03 1792 0.115E-01 0.584E-02
DAV: 3 -0.902697131060E+03 0.31431E-04 -0.12616E-04 1872 0.206E-02 0.379E-02
DAV: 4 -0.902697123681E+03 0.73799E-05 -0.13396E-04 1696 0.234E-02 0.127E-02
DAV: 5 -0.902697125179E+03 -0.14984E-05 -0.40665E-05 1384 0.108E-02
95 F= -.90269713E+03 E0= -.90272717E+03 d E =-.268148E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902698631551E+03 -0.15079E-02 -0.33016E-01 1552 0.964E-01 0.146E-01
DAV: 2 -0.902699488490E+03 -0.85694E-03 -0.94571E-03 1776 0.147E-01 0.782E-02
DAV: 3 -0.902699456233E+03 0.32256E-04 -0.21233E-04 1888 0.267E-02 0.516E-02
DAV: 4 -0.902699475142E+03 -0.18909E-04 -0.14913E-04 1840 0.284E-02 0.452E-02
DAV: 5 -0.902699447643E+03 0.27499E-04 -0.13882E-04 1832 0.201E-02 0.208E-02
DAV: 6 -0.902699445304E+03 0.23392E-05 -0.20719E-05 1048 0.872E-03
96 F= -.90269945E+03 E0= -.90272946E+03 d E =-.232013E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902698488722E+03 0.95892E-03 -0.10260E+00 1552 0.170E+00 0.257E-01
DAV: 2 -0.902701173978E+03 -0.26853E-02 -0.29550E-02 1776 0.259E-01 0.138E-01
DAV: 3 -0.902701077418E+03 0.96560E-04 -0.66483E-04 1904 0.472E-02 0.938E-02
DAV: 4 -0.902701182970E+03 -0.10555E-03 -0.46164E-04 1832 0.459E-02 0.101E-01
DAV: 5 -0.902701024400E+03 0.15857E-03 -0.46946E-04 1880 0.400E-02 0.310E-02
DAV: 6 -0.902701030654E+03 -0.62542E-05 -0.10232E-04 1624 0.170E-02 0.242E-02
DAV: 7 -0.902701025614E+03 0.50400E-05 -0.56546E-05 1384 0.134E-02
97 F= -.90270103E+03 E0= -.90273096E+03 d E =-.390044E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902702429177E+03 -0.13985E-02 -0.21942E-01 1552 0.780E-01 0.123E-01
DAV: 2 -0.902703012923E+03 -0.58375E-03 -0.64482E-03 1792 0.122E-01 0.696E-02
DAV: 3 -0.902703004916E+03 0.80066E-05 -0.22022E-04 1904 0.264E-02 0.569E-02
DAV: 4 -0.902702988269E+03 0.16648E-04 -0.10658E-04 1704 0.192E-02 0.413E-02
DAV: 5 -0.902702972040E+03 0.16229E-04 -0.80283E-05 1816 0.201E-02 0.949E-03
DAV: 6 -0.902702974537E+03 -0.24976E-05 -0.29552E-05 1248 0.902E-03
98 F= -.90270297E+03 E0= -.90273285E+03 d E =-.194892E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902701880029E+03 0.10920E-02 -0.12617E+00 1552 0.187E+00 0.293E-01
DAV: 2 -0.902705225261E+03 -0.33452E-02 -0.36937E-02 1784 0.292E-01 0.168E-01
DAV: 3 -0.902705168145E+03 0.57116E-04 -0.12476E-03 1904 0.633E-02 0.138E-01
DAV: 4 -0.902705069189E+03 0.98957E-04 -0.60340E-04 1856 0.463E-02 0.996E-02
DAV: 5 -0.902704967296E+03 0.10189E-03 -0.49348E-04 1920 0.498E-02 0.238E-02
DAV: 6 -0.902704979742E+03 -0.12446E-04 -0.18504E-04 1656 0.223E-02 0.256E-02
DAV: 7 -0.902704973460E+03 0.62813E-05 -0.56198E-05 1368 0.143E-02
99 F= -.90270497E+03 E0= -.90273478E+03 d E =-.394785E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902706517322E+03 -0.15376E-02 -0.42763E-01 1552 0.106E+00 0.172E-01
DAV: 2 -0.902707577209E+03 -0.10599E-02 -0.11742E-02 1776 0.164E-01 0.969E-02
DAV: 3 -0.902707564855E+03 0.12355E-04 -0.34315E-04 1904 0.356E-02 0.744E-02
DAV: 4 -0.902707548626E+03 0.16229E-04 -0.22151E-04 1856 0.274E-02 0.624E-02
DAV: 5 -0.902707506658E+03 0.41968E-04 -0.15568E-04 1864 0.260E-02 0.123E-02
DAV: 6 -0.902707511223E+03 -0.45650E-05 -0.49967E-05 1440 0.117E-02
100 F= -.90270751E+03 E0= -.90273732E+03 d E =-.253776E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902706420590E+03 0.10861E-02 -0.12547E+00 1552 0.182E+00 0.294E-01
DAV: 2 -0.902709516819E+03 -0.30962E-02 -0.34420E-02 1776 0.281E-01 0.164E-01
DAV: 3 -0.902709459944E+03 0.56875E-04 -0.95936E-04 1880 0.594E-02 0.122E-01
DAV: 4 -0.902709450984E+03 0.89603E-05 -0.64891E-04 1848 0.472E-02 0.110E-01
DAV: 5 -0.902709308193E+03 0.14279E-03 -0.48348E-04 1888 0.455E-02 0.230E-02
DAV: 6 -0.902709320504E+03 -0.12310E-04 -0.14682E-04 1664 0.203E-02 0.233E-02
DAV: 7 -0.902709315295E+03 0.52086E-05 -0.45473E-05 1296 0.124E-02
101 F= -.90270932E+03 E0= -.90273919E+03 d E =-.434183E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902710877435E+03 -0.15569E-02 -0.58707E-01 1552 0.122E+00 0.206E-01
DAV: 2 -0.902712289997E+03 -0.14126E-02 -0.15761E-02 1784 0.187E-01 0.115E-01
DAV: 3 -0.902712243236E+03 0.46761E-04 -0.39401E-04 1856 0.355E-02 0.752E-02
DAV: 4 -0.902712330185E+03 -0.86949E-04 -0.32154E-04 1840 0.330E-02 0.845E-02
DAV: 5 -0.902712207801E+03 0.12238E-03 -0.21731E-04 1896 0.295E-02 0.174E-02
DAV: 6 -0.902712215581E+03 -0.77794E-05 -0.53728E-05 1496 0.123E-02
102 F= -.90271222E+03 E0= -.90274215E+03 d E =-.290029E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902711506209E+03 0.70159E-03 -0.88919E-01 1536 0.150E+00 0.254E-01
DAV: 2 -0.902713640432E+03 -0.21342E-02 -0.23849E-02 1784 0.231E-01 0.141E-01
DAV: 3 -0.902713567717E+03 0.72715E-04 -0.58407E-04 1856 0.434E-02 0.920E-02
DAV: 4 -0.902713696579E+03 -0.12886E-03 -0.49213E-04 1824 0.418E-02 0.103E-01
DAV: 5 -0.902713516802E+03 0.17978E-03 -0.34441E-04 1904 0.368E-02 0.234E-02
DAV: 6 -0.902713526120E+03 -0.93180E-05 -0.80651E-05 1600 0.153E-02
103 F= -.90271353E+03 E0= -.90274351E+03 d E =-.421082E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902715257619E+03 -0.17408E-02 -0.52381E-01 1544 0.112E+00 0.203E-01
DAV: 2 -0.902716458708E+03 -0.12011E-02 -0.13483E-02 1760 0.174E-01 0.112E-01
DAV: 3 -0.902716431248E+03 0.27460E-04 -0.37467E-04 1880 0.346E-02 0.800E-02
DAV: 4 -0.902716470970E+03 -0.39723E-04 -0.31061E-04 1856 0.332E-02 0.754E-02
DAV: 5 -0.902716379746E+03 0.91224E-04 -0.20409E-04 1856 0.271E-02 0.154E-02
DAV: 6 -0.902716384373E+03 -0.46266E-05 -0.49985E-05 1376 0.119E-02
104 F= -.90271638E+03 E0= -.90274635E+03 d E =-.285825E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902714661810E+03 0.17179E-02 -0.18744E+00 1536 0.212E+00 0.380E-01
DAV: 2 -0.902718940909E+03 -0.42791E-02 -0.47732E-02 1760 0.327E-01 0.212E-01
DAV: 3 -0.902718848878E+03 0.92031E-04 -0.13319E-03 1896 0.655E-02 0.154E-01
DAV: 4 -0.902718955029E+03 -0.10615E-03 -0.10960E-03 1856 0.614E-02 0.138E-01
DAV: 5 -0.902718643546E+03 0.31148E-03 -0.66202E-04 1872 0.493E-02 0.281E-02
DAV: 6 -0.902718658308E+03 -0.14762E-04 -0.18095E-04 1680 0.217E-02 0.224E-02
DAV: 7 -0.902718657080E+03 0.12286E-05 -0.48184E-05 1344 0.122E-02
105 F= -.90271866E+03 E0= -.90274868E+03 d E =-.513096E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902720879100E+03 -0.22208E-02 -0.76789E-01 1536 0.128E+00 0.241E-01
DAV: 2 -0.902722433259E+03 -0.15542E-02 -0.17784E-02 1736 0.194E-01 0.138E-01
DAV: 3 -0.902722353926E+03 0.79333E-04 -0.40912E-04 1848 0.368E-02 0.804E-02
DAV: 4 -0.902722392497E+03 -0.38571E-04 -0.30296E-04 1824 0.343E-02 0.550E-02
DAV: 5 -0.902722343406E+03 0.49091E-04 -0.16054E-04 1864 0.212E-02 0.195E-02
DAV: 6 -0.902722342312E+03 0.10945E-05 -0.22646E-05 1128 0.996E-03
106 F= -.90272234E+03 E0= -.90275236E+03 d E =-.368523E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902719664193E+03 0.26792E-02 -0.29389E+00 1536 0.250E+00 0.468E-01
DAV: 2 -0.902725589695E+03 -0.59255E-02 -0.67804E-02 1744 0.380E-01 0.270E-01
DAV: 3 -0.902725255287E+03 0.33441E-03 -0.15234E-03 1856 0.715E-02 0.157E-01
DAV: 4 -0.902725318067E+03 -0.62780E-04 -0.11672E-03 1848 0.673E-02 0.849E-02
DAV: 5 -0.902725224352E+03 0.93716E-04 -0.54266E-04 1880 0.385E-02 0.414E-02
DAV: 6 -0.902725206133E+03 0.18219E-04 -0.80144E-05 1688 0.194E-02 0.230E-02
DAV: 7 -0.902725207828E+03 -0.16959E-05 -0.10908E-04 1552 0.177E-02 0.123E-02
DAV: 8 -0.902725206862E+03 0.96607E-06 -0.89508E-06 864 0.685E-03
107 F= -.90272521E+03 E0= -.90275531E+03 d E =-.654978E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902727252070E+03 -0.20442E-02 -0.51399E-01 1536 0.980E-01 0.198E-01
DAV: 2 -0.902728188237E+03 -0.93617E-03 -0.10731E-02 1760 0.145E-01 0.117E-01
DAV: 3 -0.902728155800E+03 0.32438E-04 -0.27890E-04 1912 0.306E-02 0.724E-02
DAV: 4 -0.902728249259E+03 -0.93460E-04 -0.33787E-04 1784 0.314E-02 0.759E-02
DAV: 5 -0.902728126276E+03 0.12298E-03 -0.14924E-04 1856 0.229E-02 0.110E-02
DAV: 6 -0.902728133281E+03 -0.70049E-05 -0.33919E-05 1136 0.885E-03
108 F= -.90272813E+03 E0= -.90275824E+03 d E =-.292642E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902726487501E+03 0.16388E-02 -0.24920E+00 1536 0.216E+00 0.436E-01
DAV: 2 -0.902731038383E+03 -0.45509E-02 -0.52140E-02 1760 0.319E-01 0.259E-01
DAV: 3 -0.902730944981E+03 0.93402E-04 -0.14557E-03 1928 0.706E-02 0.175E-01
DAV: 4 -0.902731225487E+03 -0.28051E-03 -0.17617E-03 1792 0.714E-02 0.157E-01
DAV: 5 -0.902730726563E+03 0.49892E-03 -0.65951E-04 1896 0.496E-02 0.298E-02
DAV: 6 -0.902730745865E+03 -0.19302E-04 -0.20456E-04 1728 0.213E-02 0.198E-02
DAV: 7 -0.902730747537E+03 -0.16722E-05 -0.49027E-05 1384 0.117E-02
109 F= -.90273075E+03 E0= -.90276095E+03 d E =-.554067E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902733267567E+03 -0.25217E-02 -0.44936E-01 1536 0.820E-01 0.191E-01
DAV: 2 -0.902734075058E+03 -0.80749E-03 -0.87971E-03 1816 0.124E-01 0.118E-01
DAV: 3 -0.902734135196E+03 -0.60138E-04 -0.45394E-04 1944 0.399E-02 0.105E-01
DAV: 4 -0.902734026479E+03 0.10872E-03 -0.36297E-04 1832 0.326E-02 0.541E-02
DAV: 5 -0.902734002621E+03 0.23858E-04 -0.11118E-04 1696 0.165E-02 0.131E-02
DAV: 6 -0.902734002043E+03 0.57831E-06 -0.23305E-05 1064 0.811E-03
110 F= -.90273400E+03 E0= -.90276416E+03 d E =-.325451E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902732448174E+03 0.15544E-02 -0.32616E+00 1536 0.221E+00 0.512E-01
DAV: 2 -0.902738192642E+03 -0.57445E-02 -0.63377E-02 1824 0.331E-01 0.319E-01
DAV: 3 -0.902738543552E+03 -0.35091E-03 -0.31748E-03 1920 0.106E-01 0.282E-01
DAV: 4 -0.902737887674E+03 0.65588E-03 -0.26797E-03 1832 0.883E-02 0.152E-01
DAV: 5 -0.902737651718E+03 0.23596E-03 -0.80215E-04 1760 0.457E-02 0.414E-02
DAV: 6 -0.902737639849E+03 0.11869E-04 -0.22166E-04 1712 0.233E-02 0.193E-02
DAV: 7 -0.902737644875E+03 -0.50264E-05 -0.59724E-05 1416 0.124E-02
111 F= -.90273764E+03 E0= -.90276777E+03 d E =-.689734E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902740225419E+03 -0.25856E-02 -0.59319E-01 1544 0.926E-01 0.219E-01
DAV: 2 -0.902741298372E+03 -0.10730E-02 -0.12033E-02 1800 0.139E-01 0.134E-01
DAV: 3 -0.902741331471E+03 -0.33099E-04 -0.53474E-04 1944 0.456E-02 0.111E-01
DAV: 4 -0.902741261198E+03 0.70273E-04 -0.47731E-04 1800 0.375E-02 0.679E-02
DAV: 5 -0.902741212558E+03 0.48640E-04 -0.14889E-04 1816 0.214E-02 0.147E-02
DAV: 6 -0.902741213554E+03 -0.99582E-06 -0.38722E-05 1152 0.105E-02
112 F= -.90274121E+03 E0= -.90277133E+03 d E =-.356868E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902740488912E+03 0.72365E-03 -0.20002E+00 1544 0.171E+00 0.402E-01
DAV: 2 -0.902744090360E+03 -0.36014E-02 -0.40575E-02 1800 0.255E-01 0.247E-01
DAV: 3 -0.902744191744E+03 -0.10138E-03 -0.18310E-03 1944 0.852E-02 0.205E-01
DAV: 4 -0.902743957127E+03 0.23462E-03 -0.16548E-03 1792 0.692E-02 0.126E-01
DAV: 5 -0.902743765830E+03 0.19130E-03 -0.49378E-04 1840 0.392E-02 0.299E-02
DAV: 6 -0.902743766702E+03 -0.87218E-06 -0.15356E-04 1696 0.197E-02 0.167E-02
DAV: 7 -0.902743768899E+03 -0.21965E-05 -0.45598E-05 1352 0.111E-02
113 F= -.90274377E+03 E0= -.90277380E+03 d E =-.612402E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902746740297E+03 -0.29736E-02 -0.11723E+00 1536 0.143E+00 0.292E-01
DAV: 2 -0.902748749165E+03 -0.20089E-02 -0.23621E-02 1768 0.205E-01 0.174E-01
DAV: 3 -0.902748656620E+03 0.92545E-04 -0.56864E-04 1872 0.407E-02 0.982E-02
DAV: 4 -0.902748859045E+03 -0.20242E-03 -0.54174E-04 1896 0.468E-02 0.110E-01
DAV: 5 -0.902748623003E+03 0.23604E-03 -0.35466E-04 1896 0.323E-02 0.191E-02
DAV: 6 -0.902748637781E+03 -0.14778E-04 -0.70374E-05 1504 0.129E-02 0.137E-02
DAV: 7 -0.902748639117E+03 -0.13367E-05 -0.21001E-05 1056 0.771E-03
114 F= -.90274864E+03 E0= -.90277870E+03 d E =-.487022E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902742599039E+03 0.60387E-02 -0.66726E+00 1536 0.341E+00 0.697E-01
DAV: 2 -0.902754076100E+03 -0.11477E-01 -0.13457E-01 1768 0.490E-01 0.413E-01
DAV: 3 -0.902753432541E+03 0.64356E-03 -0.30525E-03 1880 0.938E-02 0.227E-01
DAV: 4 -0.902754114918E+03 -0.68238E-03 -0.23140E-03 1912 0.100E-01 0.208E-01
DAV: 5 -0.902753324563E+03 0.79036E-03 -0.15432E-03 1888 0.659E-02 0.492E-02
DAV: 6 -0.902753370312E+03 -0.45749E-04 -0.27446E-04 1800 0.279E-02 0.313E-02
DAV: 7 -0.902753376556E+03 -0.62443E-05 -0.11949E-04 1600 0.176E-02 0.168E-02
DAV: 8 -0.902753381147E+03 -0.45906E-05 -0.79193E-06 920 0.751E-03
115 F= -.90275338E+03 E0= -.90278344E+03 d E =-.961225E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902754763912E+03 -0.13874E-02 -0.20619E+00 1536 0.184E+00 0.389E-01
DAV: 2 -0.902758323149E+03 -0.35592E-02 -0.41611E-02 1816 0.266E-01 0.244E-01
DAV: 3 -0.902758170055E+03 0.15309E-03 -0.15194E-03 1912 0.639E-02 0.157E-01
DAV: 4 -0.902758435053E+03 -0.26500E-03 -0.13523E-03 1856 0.695E-02 0.158E-01
DAV: 5 -0.902758010847E+03 0.42421E-03 -0.72561E-04 1920 0.515E-02 0.326E-02
DAV: 6 -0.902758033669E+03 -0.22822E-04 -0.18002E-04 1752 0.221E-02 0.198E-02
DAV: 7 -0.902758035188E+03 -0.15200E-05 -0.62871E-05 1464 0.127E-02
116 F= -.90275804E+03 E0= -.90278810E+03 d E =-.465404E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902757982160E+03 0.51509E-04 -0.17431E-01 1536 0.534E-01 0.115E-01
DAV: 2 -0.902758286727E+03 -0.30457E-03 -0.35260E-03 1816 0.773E-02 0.701E-02
DAV: 3 -0.902758282034E+03 0.46927E-05 -0.12182E-04 1680 0.176E-02 0.454E-02
DAV: 4 -0.902758304653E+03 -0.22619E-04 -0.10451E-04 1568 0.195E-02 0.443E-02
DAV: 5 -0.902758270422E+03 0.34231E-04 -0.53506E-05 1504 0.141E-02 0.694E-03
DAV: 6 -0.902758273276E+03 -0.28541E-05 -0.14334E-05 1008 0.587E-03
117 F= -.90275827E+03 E0= -.90278835E+03 d E =-.489213E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902759750529E+03 -0.14801E-02 -0.12165E+00 1536 0.141E+00 0.315E-01
DAV: 2 -0.902761989619E+03 -0.22391E-02 -0.24584E-02 1800 0.210E-01 0.207E-01
DAV: 3 -0.902762103047E+03 -0.11343E-03 -0.17604E-03 1944 0.791E-02 0.191E-01
DAV: 4 -0.902761700766E+03 0.40228E-03 -0.10130E-03 1832 0.559E-02 0.885E-02
DAV: 5 -0.902761678729E+03 0.22037E-04 -0.34575E-04 1792 0.309E-02 0.236E-02
DAV: 6 -0.902761673689E+03 0.50397E-05 -0.73669E-05 1520 0.164E-02
118 F= -.90276167E+03 E0= -.90279169E+03 d E =-.340041E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902761612461E+03 0.66268E-04 -0.17532E-01 1536 0.535E-01 0.122E-01
DAV: 2 -0.902761946909E+03 -0.33445E-03 -0.36553E-03 1800 0.812E-02 0.791E-02
DAV: 3 -0.902761967925E+03 -0.21016E-04 -0.26255E-04 1936 0.313E-02 0.725E-02
DAV: 4 -0.902761907711E+03 0.60214E-04 -0.16132E-04 1768 0.220E-02 0.332E-02
DAV: 5 -0.902761906630E+03 0.10813E-05 -0.47853E-05 1336 0.115E-02
119 F= -.90276191E+03 E0= -.90279193E+03 d E =-.363335E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902763295486E+03 -0.13878E-02 -0.80721E-01 1536 0.120E+00 0.255E-01
DAV: 2 -0.902764745630E+03 -0.14501E-02 -0.16843E-02 1800 0.177E-01 0.152E-01
DAV: 3 -0.902764736228E+03 0.94017E-05 -0.62833E-04 1864 0.470E-02 0.110E-01
DAV: 4 -0.902764781971E+03 -0.45743E-04 -0.59706E-04 1856 0.427E-02 0.902E-02
DAV: 5 -0.902764652991E+03 0.12898E-03 -0.22406E-04 1888 0.302E-02 0.155E-02
DAV: 6 -0.902764660798E+03 -0.78068E-05 -0.75030E-05 1448 0.131E-02
120 F= -.90276466E+03 E0= -.90279468E+03 d E =-.275417E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902764444732E+03 0.20826E-03 -0.47345E-01 1536 0.920E-01 0.196E-01
DAV: 2 -0.902765311953E+03 -0.86722E-03 -0.10025E-02 1808 0.137E-01 0.116E-01
DAV: 3 -0.902765309923E+03 0.20298E-05 -0.37204E-04 1864 0.365E-02 0.855E-02
DAV: 4 -0.902765328796E+03 -0.18873E-04 -0.35436E-04 1840 0.332E-02 0.683E-02
DAV: 5 -0.902765260256E+03 0.68539E-04 -0.13381E-04 1832 0.228E-02 0.123E-02
DAV: 6 -0.902765264512E+03 -0.42559E-05 -0.39710E-05 1128 0.104E-02
121 F= -.90276526E+03 E0= -.90279533E+03 d E =-.335788E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902766156380E+03 -0.89612E-03 -0.79097E-01 1536 0.117E+00 0.252E-01
DAV: 2 -0.902767639106E+03 -0.14827E-02 -0.17474E-02 1792 0.179E-01 0.150E-01
DAV: 3 -0.902767591572E+03 0.47534E-04 -0.54627E-04 1880 0.470E-02 0.101E-01
DAV: 4 -0.902767709079E+03 -0.11751E-03 -0.62430E-04 1848 0.442E-02 0.960E-02
DAV: 5 -0.902767539326E+03 0.16975E-03 -0.27537E-04 1904 0.307E-02 0.180E-02
DAV: 6 -0.902767548238E+03 -0.89119E-05 -0.73829E-05 1440 0.143E-02
122 F= -.90276755E+03 E0= -.90279763E+03 d E =-.228373E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902767544735E+03 -0.54087E-05 -0.57409E-02 1536 0.317E-01 0.695E-02
DAV: 2 -0.902767658137E+03 -0.11340E-03 -0.13232E-03 1800 0.495E-02 0.405E-02
DAV: 3 -0.902767654417E+03 0.37203E-05 -0.38096E-05 1464 0.136E-02
123 F= -.90276765E+03 E0= -.90279759E+03 d E =-.238990E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902768980955E+03 -0.13228E-02 -0.26983E-01 1536 0.690E-01 0.154E-01
DAV: 2 -0.902769464239E+03 -0.48328E-03 -0.58516E-03 1816 0.103E-01 0.929E-02
DAV: 3 -0.902769441689E+03 0.22549E-04 -0.24779E-04 1856 0.245E-02 0.541E-02
DAV: 4 -0.902769496903E+03 -0.55214E-04 -0.18798E-04 1696 0.230E-02 0.563E-02
DAV: 5 -0.902769437471E+03 0.59432E-04 -0.92930E-05 1736 0.180E-02 0.127E-02
DAV: 6 -0.902769440920E+03 -0.34487E-05 -0.20821E-05 1072 0.719E-03
124 F= -.90276944E+03 E0= -.90279954E+03 d E =-.178650E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902769511226E+03 -0.73755E-04 -0.43933E-01 1536 0.878E-01 0.189E-01
DAV: 2 -0.902770368381E+03 -0.85715E-03 -0.97135E-03 1824 0.134E-01 0.122E-01
DAV: 3 -0.902770406417E+03 -0.38036E-04 -0.64736E-04 1936 0.437E-02 0.110E-01
DAV: 4 -0.902770282646E+03 0.12377E-03 -0.33195E-04 1872 0.329E-02 0.546E-02
DAV: 5 -0.902770275174E+03 0.74720E-05 -0.13950E-04 1800 0.199E-02 0.142E-02
DAV: 6 -0.902770274826E+03 0.34802E-06 -0.32140E-05 1072 0.932E-03
125 F= -.90277027E+03 E0= -.90280033E+03 d E =-.262041E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902771378212E+03 -0.11030E-02 -0.20542E-01 1536 0.627E-01 0.127E-01
DAV: 2 -0.902771788623E+03 -0.41041E-03 -0.48088E-03 1800 0.947E-02 0.746E-02
DAV: 3 -0.902771774051E+03 0.14572E-04 -0.14149E-04 1840 0.201E-02 0.451E-02
DAV: 4 -0.902771811598E+03 -0.37547E-04 -0.12439E-04 1632 0.197E-02 0.483E-02
DAV: 5 -0.902771768446E+03 0.43151E-04 -0.70178E-05 1632 0.154E-02 0.949E-03
DAV: 6 -0.902771771168E+03 -0.27220E-05 -0.15150E-05 1056 0.640E-03
126 F= -.90277177E+03 E0= -.90280189E+03 d E =-.149634E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902771628383E+03 0.14006E-03 -0.57813E-01 1536 0.105E+00 0.213E-01
DAV: 2 -0.902772769130E+03 -0.11407E-02 -0.13383E-02 1800 0.158E-01 0.125E-01
DAV: 3 -0.902772722555E+03 0.46575E-04 -0.40057E-04 1896 0.341E-02 0.739E-02
DAV: 4 -0.902772810825E+03 -0.88270E-04 -0.31730E-04 1848 0.318E-02 0.740E-02
DAV: 5 -0.902772711227E+03 0.99598E-04 -0.18652E-04 1880 0.246E-02 0.173E-02
DAV: 6 -0.902772715164E+03 -0.39371E-05 -0.36651E-05 1168 0.105E-02
127 F= -.90277272E+03 E0= -.90280291E+03 d E =-.244034E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902773558707E+03 -0.84748E-03 -0.36866E-01 1536 0.852E-01 0.166E-01
DAV: 2 -0.902774315556E+03 -0.75685E-03 -0.87588E-03 1768 0.131E-01 0.946E-02
DAV: 3 -0.902774281405E+03 0.34151E-04 -0.24392E-04 1896 0.278E-02 0.645E-02
DAV: 4 -0.902774335687E+03 -0.54281E-04 -0.25129E-04 1792 0.268E-02 0.626E-02
DAV: 5 -0.902774263299E+03 0.72388E-04 -0.13117E-04 1816 0.217E-02 0.121E-02
DAV: 6 -0.902774268473E+03 -0.51742E-05 -0.32965E-05 1080 0.894E-03
128 F= -.90277427E+03 E0= -.90280446E+03 d E =-.155331E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902773674542E+03 0.58876E-03 -0.72258E-01 1536 0.119E+00 0.233E-01
DAV: 2 -0.902775164514E+03 -0.14900E-02 -0.17259E-02 1760 0.183E-01 0.132E-01
DAV: 3 -0.902775098289E+03 0.66225E-04 -0.48464E-04 1904 0.396E-02 0.905E-02
DAV: 4 -0.902775196645E+03 -0.98355E-04 -0.48275E-04 1800 0.380E-02 0.860E-02
DAV: 5 -0.902775060859E+03 0.13579E-03 -0.25640E-04 1904 0.306E-02 0.173E-02
DAV: 6 -0.902775069054E+03 -0.81954E-05 -0.67618E-05 1344 0.126E-02
129 F= -.90277507E+03 E0= -.90280529E+03 d E =-.235389E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902775998170E+03 -0.93731E-03 -0.38489E-01 1536 0.920E-01 0.169E-01
DAV: 2 -0.902776846863E+03 -0.84869E-03 -0.96459E-03 1792 0.143E-01 0.992E-02
DAV: 3 -0.902776849952E+03 -0.30887E-05 -0.36651E-04 1920 0.358E-02 0.822E-02
DAV: 4 -0.902776808764E+03 0.41188E-04 -0.22339E-04 1784 0.272E-02 0.524E-02
DAV: 5 -0.902776790402E+03 0.18362E-04 -0.12216E-04 1808 0.232E-02 0.116E-02
DAV: 6 -0.902776792599E+03 -0.21973E-05 -0.37204E-05 1200 0.102E-02
130 F= -.90277679E+03 E0= -.90280700E+03 d E =-.172354E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902773530971E+03 0.32594E-02 -0.25134E+00 1536 0.235E+00 0.429E-01
DAV: 2 -0.902779060478E+03 -0.55295E-02 -0.62425E-02 1792 0.363E-01 0.255E-01
DAV: 3 -0.902779072365E+03 -0.11887E-04 -0.25101E-03 1928 0.926E-02 0.217E-01
DAV: 4 -0.902778752678E+03 0.31969E-03 -0.14177E-03 1824 0.687E-02 0.134E-01
DAV: 5 -0.902778627964E+03 0.12471E-03 -0.80205E-04 1912 0.598E-02 0.295E-02
DAV: 6 -0.902778641580E+03 -0.13616E-04 -0.26443E-04 1656 0.259E-02 0.275E-02
DAV: 7 -0.902778635437E+03 0.61430E-05 -0.69958E-05 1488 0.158E-02
131 F= -.90277864E+03 E0= -.90280884E+03 d E =-.356638E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902779172899E+03 -0.53132E-03 -0.61638E-01 1536 0.119E+00 0.216E-01
DAV: 2 -0.902780622868E+03 -0.14500E-02 -0.16071E-02 1792 0.186E-01 0.134E-01
DAV: 3 -0.902780666261E+03 -0.43393E-04 -0.78439E-04 1896 0.525E-02 0.119E-01
DAV: 4 -0.902780526750E+03 0.13951E-03 -0.36504E-04 1776 0.345E-02 0.645E-02
DAV: 5 -0.902780514370E+03 0.12380E-04 -0.17891E-04 1800 0.276E-02 0.134E-02
DAV: 6 -0.902780517411E+03 -0.30409E-05 -0.55456E-05 1456 0.121E-02
132 F= -.90278052E+03 E0= -.90281063E+03 d E =-.188197E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902780171980E+03 0.34239E-03 -0.37574E-01 1536 0.931E-01 0.169E-01
DAV: 2 -0.902781060320E+03 -0.88834E-03 -0.98811E-03 1784 0.146E-01 0.104E-01
DAV: 3 -0.902781088123E+03 -0.27804E-04 -0.48339E-04 1888 0.412E-02 0.925E-02
DAV: 4 -0.902781002441E+03 0.85682E-04 -0.22220E-04 1800 0.270E-02 0.504E-02
DAV: 5 -0.902780995028E+03 0.74137E-05 -0.11588E-04 1768 0.227E-02 0.112E-02
DAV: 6 -0.902780996527E+03 -0.14992E-05 -0.35923E-05 1304 0.997E-03
133 F= -.90278100E+03 E0= -.90281107E+03 d E =-.236109E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902781754058E+03 -0.75903E-03 -0.37623E-01 1536 0.898E-01 0.163E-01
DAV: 2 -0.902782587227E+03 -0.83317E-03 -0.93563E-03 1776 0.139E-01 0.103E-01
DAV: 3 -0.902782584523E+03 0.27035E-05 -0.46786E-04 1880 0.399E-02 0.898E-02
DAV: 4 -0.902782502519E+03 0.82004E-04 -0.21772E-04 1768 0.267E-02 0.491E-02
DAV: 5 -0.902782494906E+03 0.76131E-05 -0.13410E-04 1752 0.216E-02 0.122E-02
DAV: 6 -0.902782495636E+03 -0.72960E-06 -0.34506E-05 1256 0.975E-03
134 F= -.90278250E+03 E0= -.90281255E+03 d E =-.149911E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902781955721E+03 0.53918E-03 -0.64946E-01 1536 0.118E+00 0.215E-01
DAV: 2 -0.902783390973E+03 -0.14353E-02 -0.16058E-02 1776 0.182E-01 0.137E-01
DAV: 3 -0.902783382110E+03 0.88633E-05 -0.80392E-04 1896 0.535E-02 0.119E-01
DAV: 4 -0.902783235402E+03 0.14671E-03 -0.37503E-04 1784 0.355E-02 0.645E-02
DAV: 5 -0.902783223009E+03 0.12393E-04 -0.23498E-04 1784 0.283E-02 0.160E-02
DAV: 6 -0.902783224244E+03 -0.12348E-05 -0.59777E-05 1456 0.128E-02
135 F= -.90278322E+03 E0= -.90281327E+03 d E =-.222772E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902783856214E+03 -0.63320E-03 -0.39941E-01 1536 0.940E-01 0.168E-01
DAV: 2 -0.902784708039E+03 -0.85183E-03 -0.98977E-03 1760 0.143E-01 0.909E-02
DAV: 3 -0.902784670996E+03 0.37043E-04 -0.21426E-04 1888 0.251E-02 0.555E-02
DAV: 4 -0.902784674467E+03 -0.34711E-05 -0.17218E-04 1760 0.273E-02 0.254E-02
DAV: 5 -0.902784672229E+03 0.22382E-05 -0.86452E-05 1776 0.155E-02
136 F= -.90278467E+03 E0= -.90281495E+03 d E =-.144798E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902782430931E+03 0.22435E-02 -0.17370E+00 1536 0.196E+00 0.351E-01
DAV: 2 -0.902786098534E+03 -0.36676E-02 -0.42774E-02 1760 0.298E-01 0.189E-01
DAV: 3 -0.902785928701E+03 0.16983E-03 -0.10033E-03 1896 0.538E-02 0.115E-01
DAV: 4 -0.902785886381E+03 0.42320E-04 -0.64462E-04 1888 0.545E-02 0.283E-02
DAV: 5 -0.902785913147E+03 -0.26765E-04 -0.29464E-04 1848 0.268E-02 0.352E-02
DAV: 6 -0.902785897395E+03 0.15751E-04 -0.37386E-05 1496 0.116E-02 0.210E-02
DAV: 7 -0.902785894776E+03 0.26190E-05 -0.56229E-05 1424 0.146E-02
137 F= -.90278589E+03 E0= -.90281607E+03 d E =-.267053E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902786223527E+03 -0.32613E-03 -0.62717E-01 1536 0.119E+00 0.210E-01
DAV: 2 -0.902787606074E+03 -0.13825E-02 -0.15993E-02 1760 0.182E-01 0.119E-01
DAV: 3 -0.902787564885E+03 0.41189E-04 -0.44943E-04 1856 0.383E-02 0.869E-02
DAV: 4 -0.902787587838E+03 -0.22953E-04 -0.33404E-04 1840 0.322E-02 0.741E-02
DAV: 5 -0.902787500855E+03 0.86984E-04 -0.18256E-04 1856 0.270E-02 0.111E-02
DAV: 6 -0.902787509513E+03 -0.86582E-05 -0.62584E-05 1488 0.113E-02
138 F= -.90278751E+03 E0= -.90281770E+03 d E =-.161474E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902786873322E+03 0.62753E-03 -0.55461E-01 1536 0.112E+00 0.199E-01
DAV: 2 -0.902788099437E+03 -0.12261E-02 -0.14247E-02 1760 0.172E-01 0.112E-01
DAV: 3 -0.902788067499E+03 0.31938E-04 -0.41126E-04 1856 0.372E-02 0.824E-02
DAV: 4 -0.902788081800E+03 -0.14301E-04 -0.29625E-04 1840 0.306E-02 0.693E-02
DAV: 5 -0.902788008808E+03 0.72992E-04 -0.16812E-04 1856 0.265E-02 0.115E-02
DAV: 6 -0.902788015858E+03 -0.70507E-05 -0.57659E-05 1472 0.112E-02
139 F= -.90278802E+03 E0= -.90281820E+03 d E =-.212108E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902788630286E+03 -0.62148E-03 -0.43264E-01 1536 0.953E-01 0.173E-01
DAV: 2 -0.902789516034E+03 -0.88575E-03 -0.10172E-02 1792 0.144E-01 0.107E-01
DAV: 3 -0.902789529781E+03 -0.13747E-04 -0.47272E-04 1888 0.406E-02 0.944E-02
DAV: 4 -0.902789435338E+03 0.94443E-04 -0.22738E-04 1832 0.280E-02 0.513E-02
DAV: 5 -0.902789422841E+03 0.12498E-04 -0.12518E-04 1712 0.205E-02 0.104E-02
DAV: 6 -0.902789425026E+03 -0.21857E-05 -0.34455E-05 1240 0.915E-03
140 F= -.90278943E+03 E0= -.90281955E+03 d E =-.140917E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902788555028E+03 0.86781E-03 -0.89884E-01 1536 0.137E+00 0.247E-01
DAV: 2 -0.902790405815E+03 -0.18508E-02 -0.21049E-02 1800 0.208E-01 0.155E-01
DAV: 3 -0.902790430793E+03 -0.24978E-04 -0.99610E-04 1888 0.589E-02 0.140E-01
DAV: 4 -0.902790221560E+03 0.20923E-03 -0.47440E-04 1864 0.405E-02 0.745E-02
DAV: 5 -0.902790193598E+03 0.27962E-04 -0.26866E-04 1784 0.295E-02 0.152E-02
DAV: 6 -0.902790197783E+03 -0.41844E-05 -0.74830E-05 1504 0.131E-02
141 F= -.90279020E+03 E0= -.90282024E+03 d E =-.218192E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902790267323E+03 -0.73725E-04 -0.63864E-01 1536 0.113E+00 0.219E-01
DAV: 2 -0.902791613962E+03 -0.13466E-02 -0.15754E-02 1752 0.174E-01 0.124E-01
DAV: 3 -0.902791543703E+03 0.70259E-04 -0.40421E-04 1896 0.368E-02 0.853E-02
DAV: 4 -0.902791623936E+03 -0.80233E-04 -0.43027E-04 1840 0.352E-02 0.856E-02
DAV: 5 -0.902791485630E+03 0.13831E-03 -0.21708E-04 1928 0.279E-02 0.134E-02
DAV: 6 -0.902791493836E+03 -0.82065E-05 -0.63174E-05 1288 0.117E-02
142 F= -.90279149E+03 E0= -.90282156E+03 d E =-.129605E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902791445572E+03 0.40058E-04 -0.58579E-02 1536 0.341E-01 0.685E-02
DAV: 2 -0.902791573072E+03 -0.12750E-03 -0.14863E-03 1760 0.536E-02 0.380E-02
DAV: 3 -0.902791567918E+03 0.51541E-05 -0.39643E-05 1400 0.124E-02
143 F= -.90279157E+03 E0= -.90282141E+03 d E =-.137014E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902791931809E+03 -0.35874E-03 -0.65528E-01 1536 0.105E+00 0.223E-01
DAV: 2 -0.902793031233E+03 -0.10994E-02 -0.13554E-02 1776 0.156E-01 0.138E-01
DAV: 3 -0.902792974860E+03 0.56374E-04 -0.51598E-04 1896 0.404E-02 0.101E-01
DAV: 4 -0.902792997551E+03 -0.22692E-04 -0.48115E-04 1808 0.371E-02 0.823E-02
DAV: 5 -0.902792882334E+03 0.11522E-03 -0.20952E-04 1888 0.280E-02 0.129E-02
DAV: 6 -0.902792889762E+03 -0.74274E-05 -0.60148E-05 1240 0.117E-02
144 F= -.90279289E+03 E0= -.90282295E+03 d E =-.132184E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902792162802E+03 0.71953E-03 -0.50749E-01 1536 0.923E-01 0.192E-01
DAV: 2 -0.902793112241E+03 -0.94944E-03 -0.10969E-02 1784 0.141E-01 0.128E-01
DAV: 3 -0.902793102930E+03 0.93111E-05 -0.67332E-04 1928 0.461E-02 0.113E-01
DAV: 4 -0.902792956801E+03 0.14613E-03 -0.31994E-04 1808 0.326E-02 0.544E-02
DAV: 5 -0.902792947237E+03 0.95643E-05 -0.17199E-04 1768 0.229E-02 0.123E-02
DAV: 6 -0.902792948561E+03 -0.13235E-05 -0.37648E-05 1200 0.105E-02
145 F= -.90279295E+03 E0= -.90282301E+03 d E =-.138064E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902792921934E+03 0.25303E-04 -0.92373E-02 1536 0.393E-01 0.798E-02
DAV: 2 -0.902793084568E+03 -0.16263E-03 -0.18855E-03 1784 0.586E-02 0.541E-02
DAV: 3 -0.902793083976E+03 0.59239E-06 -0.12308E-04 1712 0.194E-02 0.476E-02
DAV: 4 -0.902793055889E+03 0.28087E-04 -0.55621E-05 1416 0.135E-02 0.213E-02
DAV: 5 -0.902793055606E+03 0.28360E-06 -0.27607E-05 1120 0.898E-03
146 F= -.90279306E+03 E0= -.90282313E+03 d E =-.148769E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902793547145E+03 -0.49126E-03 -0.56187E-01 1536 0.956E-01 0.206E-01
DAV: 2 -0.902794540092E+03 -0.99295E-03 -0.11790E-02 1832 0.146E-01 0.137E-01
DAV: 3 -0.902794557822E+03 -0.17730E-04 -0.82794E-04 1856 0.520E-02 0.126E-01
DAV: 4 -0.902794367043E+03 0.19078E-03 -0.38414E-04 1808 0.369E-02 0.576E-02
DAV: 5 -0.902794351200E+03 0.15843E-04 -0.17655E-04 1752 0.232E-02 0.130E-02
DAV: 6 -0.902794353231E+03 -0.20308E-05 -0.48383E-05 1328 0.117E-02
147 F= -.90279435E+03 E0= -.90282432E+03 d E =-.129763E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902794323185E+03 0.28016E-04 -0.97396E-02 1536 0.399E-01 0.875E-02
DAV: 2 -0.902794498269E+03 -0.17508E-03 -0.20813E-03 1824 0.619E-02 0.569E-02
DAV: 3 -0.902794506680E+03 -0.84106E-05 -0.14942E-04 1816 0.225E-02 0.527E-02
DAV: 4 -0.902794471765E+03 0.34915E-04 -0.70915E-05 1552 0.158E-02 0.240E-02
DAV: 5 -0.902794470138E+03 0.16273E-05 -0.29039E-05 1176 0.977E-03
148 F= -.90279447E+03 E0= -.90282441E+03 d E =-.141453E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902794715459E+03 -0.24369E-03 -0.59838E-01 1544 0.102E+00 0.217E-01
DAV: 2 -0.902795890848E+03 -0.11754E-02 -0.13677E-02 1808 0.160E-01 0.147E-01
DAV: 3 -0.902795880371E+03 0.10477E-04 -0.10462E-03 1904 0.560E-02 0.134E-01
DAV: 4 -0.902795657176E+03 0.22319E-03 -0.39980E-04 1824 0.385E-02 0.611E-02
DAV: 5 -0.902795644560E+03 0.12617E-04 -0.22129E-04 1808 0.262E-02 0.131E-02
DAV: 6 -0.902795647362E+03 -0.28018E-05 -0.57854E-05 1424 0.121E-02
149 F= -.90279565E+03 E0= -.90282548E+03 d E =-.117722E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902795627969E+03 0.16590E-04 -0.43559E-02 1544 0.279E-01 0.599E-02
DAV: 2 -0.902795717875E+03 -0.89906E-04 -0.10387E-03 1824 0.442E-02 0.391E-02
DAV: 3 -0.902795720483E+03 -0.26076E-05 -0.74590E-05 1520 0.154E-02
150 F= -.90279572E+03 E0= -.90282507E+03 d E =-.125035E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902796338492E+03 -0.62062E-03 -0.50291E-01 1536 0.882E-01 0.192E-01
DAV: 2 -0.902797133466E+03 -0.79497E-03 -0.98925E-03 1808 0.126E-01 0.128E-01
DAV: 3 -0.902797145010E+03 -0.11544E-04 -0.59704E-04 1936 0.394E-02 0.112E-01
DAV: 4 -0.902797018567E+03 0.12644E-03 -0.33373E-04 1840 0.352E-02 0.590E-02
DAV: 5 -0.902796990211E+03 0.28357E-04 -0.16639E-04 1784 0.216E-02 0.114E-02
DAV: 6 -0.902796992580E+03 -0.23692E-05 -0.37406E-05 1128 0.955E-03
151 F= -.90279699E+03 E0= -.90282678E+03 d E =-.127210E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902796805936E+03 0.18427E-03 -0.47495E-01 1536 0.851E-01 0.179E-01
DAV: 2 -0.902797619105E+03 -0.81317E-03 -0.95784E-03 1824 0.124E-01 0.124E-01
DAV: 3 -0.902797612444E+03 0.66610E-05 -0.63706E-04 1920 0.404E-02 0.110E-01
DAV: 4 -0.902797471864E+03 0.14058E-03 -0.26950E-04 1816 0.322E-02 0.517E-02
DAV: 5 -0.902797462306E+03 0.95579E-05 -0.15954E-04 1768 0.210E-02 0.116E-02
DAV: 6 -0.902797463243E+03 -0.93695E-06 -0.32689E-05 1144 0.961E-03
152 F= -.90279746E+03 E0= -.90282723E+03 d E =-.174276E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902798002930E+03 -0.54062E-03 -0.33117E-01 1536 0.692E-01 0.154E-01
DAV: 2 -0.902798538556E+03 -0.53563E-03 -0.66713E-03 1832 0.100E-01 0.900E-02
DAV: 3 -0.902798491250E+03 0.47307E-04 -0.19250E-04 1728 0.204E-02 0.538E-02
DAV: 4 -0.902798537477E+03 -0.46228E-04 -0.17469E-04 1704 0.262E-02 0.541E-02
DAV: 5 -0.902798475852E+03 0.61626E-04 -0.10640E-04 1824 0.176E-02 0.117E-02
DAV: 6 -0.902798479365E+03 -0.35137E-05 -0.20969E-05 1024 0.754E-03
153 F= -.90279848E+03 E0= -.90282826E+03 d E =-.101612E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902798373303E+03 0.10255E-03 -0.27409E-01 1536 0.631E-01 0.140E-01
DAV: 2 -0.902798816771E+03 -0.44347E-03 -0.55134E-03 1816 0.914E-02 0.816E-02
DAV: 3 -0.902798777199E+03 0.39572E-04 -0.15804E-04 1640 0.189E-02 0.495E-02
DAV: 4 -0.902798819795E+03 -0.42596E-04 -0.15266E-04 1712 0.243E-02 0.520E-02
DAV: 5 -0.902798761908E+03 0.57887E-04 -0.93023E-05 1768 0.167E-02 0.106E-02
DAV: 6 -0.902798765148E+03 -0.32404E-05 -0.18649E-05 1040 0.711E-03
154 F= -.90279877E+03 E0= -.90282858E+03 d E =-.130190E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902799317466E+03 -0.55556E-03 -0.34328E-01 1536 0.704E-01 0.152E-01
DAV: 2 -0.902799881677E+03 -0.56421E-03 -0.67392E-03 1824 0.102E-01 0.102E-01
DAV: 3 -0.902799886094E+03 -0.44166E-05 -0.41951E-04 1920 0.325E-02 0.923E-02
DAV: 4 -0.902799788812E+03 0.97281E-04 -0.18652E-04 1776 0.281E-02 0.436E-02
DAV: 5 -0.902799778838E+03 0.99748E-05 -0.11376E-04 1720 0.170E-02 0.955E-03
DAV: 6 -0.902799779358E+03 -0.52046E-06 -0.24742E-05 1080 0.816E-03
155 F= -.90279978E+03 E0= -.90282958E+03 d E =-.101421E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902798499746E+03 0.12791E-02 -0.16906E+00 1536 0.156E+00 0.339E-01
DAV: 2 -0.902801284414E+03 -0.27847E-02 -0.33191E-02 1832 0.227E-01 0.228E-01
DAV: 3 -0.902801289961E+03 -0.55462E-05 -0.21149E-03 1904 0.716E-02 0.210E-01
DAV: 4 -0.902800813533E+03 0.47643E-03 -0.92325E-04 1904 0.619E-02 0.999E-02
DAV: 5 -0.902800750662E+03 0.62871E-04 -0.55672E-04 1832 0.379E-02 0.206E-02
DAV: 6 -0.902800755334E+03 -0.46716E-05 -0.13008E-04 1608 0.178E-02 0.138E-02
DAV: 7 -0.902800755469E+03 -0.13519E-06 -0.22782E-05 1088 0.892E-03
156 F= -.90280076E+03 E0= -.90283054E+03 d E =-.199032E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902801394076E+03 -0.63874E-03 -0.38726E-01 1536 0.734E-01 0.166E-01
DAV: 2 -0.902802078131E+03 -0.68406E-03 -0.78262E-03 1848 0.110E-01 0.123E-01
DAV: 3 -0.902802040427E+03 0.37704E-04 -0.66637E-04 1944 0.400E-02 0.106E-01
DAV: 4 -0.902801910442E+03 0.12999E-03 -0.21569E-04 1832 0.299E-02 0.444E-02
DAV: 5 -0.902801908878E+03 0.15640E-05 -0.12169E-04 1744 0.172E-02 0.977E-03
DAV: 6 -0.902801909600E+03 -0.72121E-06 -0.24052E-05 1088 0.786E-03
157 F= -.90280191E+03 E0= -.90283165E+03 d E =-.115413E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902801741757E+03 0.16712E-03 -0.44713E-01 1536 0.789E-01 0.178E-01
DAV: 2 -0.902802532968E+03 -0.79121E-03 -0.90569E-03 1848 0.119E-01 0.133E-01
DAV: 3 -0.902802486622E+03 0.46346E-04 -0.76938E-04 1928 0.432E-02 0.113E-01
DAV: 4 -0.902802337199E+03 0.14942E-03 -0.24755E-04 1880 0.326E-02 0.478E-02
DAV: 5 -0.902802335807E+03 0.13922E-05 -0.14534E-04 1744 0.189E-02 0.108E-02
DAV: 6 -0.902802336560E+03 -0.75316E-06 -0.28785E-05 1112 0.870E-03
158 F= -.90280234E+03 E0= -.90283206E+03 d E =-.158109E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902802915248E+03 -0.57944E-03 -0.41182E-01 1536 0.715E-01 0.173E-01
DAV: 2 -0.902803556705E+03 -0.64146E-03 -0.78798E-03 1816 0.104E-01 0.110E-01
DAV: 3 -0.902803574447E+03 -0.17742E-04 -0.45077E-04 1904 0.314E-02 0.988E-02
DAV: 4 -0.902803475337E+03 0.99110E-04 -0.25351E-04 1712 0.305E-02 0.520E-02
DAV: 5 -0.902803451416E+03 0.23920E-04 -0.12104E-04 1712 0.173E-02 0.934E-03
DAV: 6 -0.902803453490E+03 -0.20739E-05 -0.26253E-05 1088 0.756E-03
159 F= -.90280345E+03 E0= -.90283320E+03 d E =-.111693E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902802761687E+03 0.68973E-03 -0.10116E+00 1536 0.112E+00 0.272E-01
DAV: 2 -0.902804341387E+03 -0.15797E-02 -0.19445E-02 1816 0.164E-01 0.174E-01
DAV: 3 -0.902804375058E+03 -0.33670E-04 -0.11338E-03 1968 0.499E-02 0.157E-01
DAV: 4 -0.902804131707E+03 0.24335E-03 -0.64244E-04 1856 0.479E-02 0.820E-02
DAV: 5 -0.902804069819E+03 0.61888E-04 -0.29924E-04 1800 0.271E-02 0.152E-02
DAV: 6 -0.902804074081E+03 -0.42619E-05 -0.65408E-05 1304 0.121E-02
160 F= -.90280407E+03 E0= -.90283387E+03 d E =-.173752E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902804554227E+03 -0.48441E-03 -0.49702E-01 1536 0.712E-01 0.186E-01
DAV: 2 -0.902805320784E+03 -0.76656E-03 -0.92462E-03 1808 0.106E-01 0.126E-01
DAV: 3 -0.902805337563E+03 -0.16779E-04 -0.68193E-04 1928 0.400E-02 0.118E-01
DAV: 4 -0.902805175790E+03 0.16177E-03 -0.29719E-04 1760 0.331E-02 0.495E-02
DAV: 5 -0.902805170730E+03 0.50595E-05 -0.13687E-04 1720 0.181E-02 0.105E-02
DAV: 6 -0.902805171855E+03 -0.11242E-05 -0.30019E-05 1104 0.843E-03
161 F= -.90280517E+03 E0= -.90283494E+03 d E =-.109777E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902804716997E+03 0.45373E-03 -0.77608E-01 1536 0.890E-01 0.231E-01
DAV: 2 -0.902805903891E+03 -0.11869E-02 -0.14377E-02 1808 0.132E-01 0.158E-01
DAV: 3 -0.902805924705E+03 -0.20814E-04 -0.10527E-03 1920 0.501E-02 0.147E-01
DAV: 4 -0.902805676565E+03 0.24814E-03 -0.46890E-04 1848 0.414E-02 0.626E-02
DAV: 5 -0.902805666019E+03 0.10545E-04 -0.21534E-04 1792 0.226E-02 0.133E-02
DAV: 6 -0.902805667692E+03 -0.16727E-05 -0.47596E-05 1168 0.106E-02
162 F= -.90280567E+03 E0= -.90283541E+03 d E =-.159361E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902806277471E+03 -0.61145E-03 -0.47017E-01 1536 0.751E-01 0.187E-01
DAV: 2 -0.902807021259E+03 -0.74379E-03 -0.93776E-03 1832 0.114E-01 0.128E-01
DAV: 3 -0.902807060347E+03 -0.39088E-04 -0.75617E-04 1888 0.425E-02 0.122E-01
DAV: 4 -0.902806885226E+03 0.17512E-03 -0.30450E-04 1896 0.353E-02 0.493E-02
DAV: 5 -0.902806883282E+03 0.19440E-05 -0.13035E-04 1712 0.195E-02 0.109E-02
DAV: 6 -0.902806885385E+03 -0.21030E-05 -0.35294E-05 1232 0.985E-03
163 F= -.90280689E+03 E0= -.90283654E+03 d E =-.121769E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902806769628E+03 0.11365E-03 -0.34323E-01 1536 0.641E-01 0.160E-01
DAV: 2 -0.902807313100E+03 -0.54347E-03 -0.68546E-03 1816 0.978E-02 0.109E-01
DAV: 3 -0.902807346361E+03 -0.33261E-04 -0.56507E-04 1896 0.371E-02 0.105E-01
DAV: 4 -0.902807213338E+03 0.13302E-03 -0.22828E-04 1872 0.306E-02 0.420E-02
DAV: 5 -0.902807213323E+03 0.14414E-07 -0.95117E-05 1680 0.165E-02
164 F= -.90280721E+03 E0= -.90283677E+03 d E =-.154563E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902807692786E+03 -0.47945E-03 -0.48209E-01 1536 0.773E-01 0.191E-01
DAV: 2 -0.902808413659E+03 -0.72087E-03 -0.94682E-03 1848 0.113E-01 0.119E-01
DAV: 3 -0.902808435477E+03 -0.21819E-04 -0.53405E-04 1888 0.339E-02 0.104E-01
DAV: 4 -0.902808357191E+03 0.78287E-04 -0.31052E-04 1824 0.332E-02 0.623E-02
DAV: 5 -0.902808319810E+03 0.37381E-04 -0.13505E-04 1720 0.203E-02 0.113E-02
DAV: 6 -0.902808324401E+03 -0.45914E-05 -0.40053E-05 1152 0.927E-03
165 F= -.90280832E+03 E0= -.90283783E+03 d E =-.111108E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902808252183E+03 0.67627E-04 -0.19763E-01 1536 0.494E-01 0.122E-01
DAV: 2 -0.902808554442E+03 -0.30226E-03 -0.39287E-03 1856 0.727E-02 0.760E-02
DAV: 3 -0.902808564364E+03 -0.99220E-05 -0.21499E-04 1768 0.219E-02 0.661E-02
DAV: 4 -0.902808531857E+03 0.32507E-04 -0.12755E-04 1528 0.211E-02 0.398E-02
DAV: 5 -0.902808518685E+03 0.13172E-04 -0.56148E-05 1456 0.131E-02 0.715E-03
DAV: 6 -0.902808520824E+03 -0.21393E-05 -0.15938E-05 1008 0.605E-03
166 F= -.90280852E+03 E0= -.90283800E+03 d E =-.130750E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902808555970E+03 -0.37285E-04 -0.66633E-01 1536 0.955E-01 0.210E-01
DAV: 2 -0.902809653197E+03 -0.10972E-02 -0.13428E-02 1776 0.140E-01 0.138E-01
DAV: 3 -0.902809687418E+03 -0.34220E-04 -0.82707E-04 1928 0.444E-02 0.131E-01
DAV: 4 -0.902809497510E+03 0.18991E-03 -0.36827E-04 1888 0.382E-02 0.621E-02
DAV: 5 -0.902809484384E+03 0.13126E-04 -0.22153E-04 1776 0.231E-02 0.136E-02
DAV: 6 -0.902809485619E+03 -0.12357E-05 -0.43963E-05 1184 0.107E-02
167 F= -.90280949E+03 E0= -.90283894E+03 d E =-.964795E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902809462042E+03 0.22342E-04 -0.44396E-02 1536 0.246E-01 0.549E-02
DAV: 2 -0.902809541363E+03 -0.79321E-04 -0.93375E-04 1776 0.373E-02 0.358E-02
DAV: 3 -0.902809544492E+03 -0.31289E-05 -0.51168E-05 1456 0.117E-02
168 F= -.90280954E+03 E0= -.90283860E+03 d E =-.102367E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902809662552E+03 -0.12119E-03 -0.27938E-01 1536 0.740E-01 0.148E-01
DAV: 2 -0.902810242132E+03 -0.57958E-03 -0.69995E-03 1784 0.114E-01 0.915E-02
DAV: 3 -0.902810224683E+03 0.17449E-04 -0.29624E-04 1912 0.282E-02 0.724E-02
DAV: 4 -0.902810216792E+03 0.78913E-05 -0.19727E-04 1784 0.261E-02 0.557E-02
DAV: 5 -0.902810178534E+03 0.38257E-04 -0.11091E-04 1720 0.178E-02 0.938E-03
DAV: 6 -0.902810182715E+03 -0.41804E-05 -0.30301E-05 1072 0.825E-03
169 F= -.90281018E+03 E0= -.90283963E+03 d E =-.638223E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902810165506E+03 0.13028E-04 -0.31439E-02 1536 0.249E-01 0.489E-02
DAV: 2 -0.902810240032E+03 -0.74526E-04 -0.83422E-04 1776 0.394E-02 0.315E-02
DAV: 3 -0.902810241114E+03 -0.10821E-05 -0.45566E-05 1448 0.111E-02
170 F= -.90281024E+03 E0= -.90283936E+03 d E =-.696623E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902810339019E+03 -0.98987E-04 -0.26432E-01 1536 0.727E-01 0.141E-01
DAV: 2 -0.902810876847E+03 -0.53783E-03 -0.64405E-03 1808 0.109E-01 0.888E-02
DAV: 3 -0.902810874491E+03 0.23561E-05 -0.27788E-04 1904 0.282E-02 0.747E-02
DAV: 4 -0.902810843379E+03 0.31111E-04 -0.16463E-04 1800 0.250E-02 0.502E-02
DAV: 5 -0.902810821482E+03 0.21897E-04 -0.10403E-04 1784 0.175E-02 0.939E-03
DAV: 6 -0.902810823625E+03 -0.21434E-05 -0.25921E-05 1072 0.851E-03
171 F= -.90281082E+03 E0= -.90284028E+03 d E =-.582511E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902810816116E+03 0.53662E-05 -0.16508E-02 1536 0.182E-01 0.349E-02
DAV: 2 -0.902810854538E+03 -0.38422E-04 -0.43000E-04 1808 0.284E-02 0.223E-02
DAV: 3 -0.902810855447E+03 -0.90869E-06 -0.21680E-05 1232 0.793E-03
172 F= -.90281086E+03 E0= -.90284010E+03 d E =-.614332E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902810801519E+03 0.53019E-04 -0.21649E-01 1536 0.638E-01 0.118E-01
DAV: 2 -0.902811238128E+03 -0.43661E-03 -0.50913E-03 1816 0.944E-02 0.787E-02
DAV: 3 -0.902811225865E+03 0.12263E-04 -0.23464E-04 1896 0.243E-02 0.681E-02
DAV: 4 -0.902811186936E+03 0.38929E-04 -0.12082E-04 1560 0.207E-02 0.412E-02
DAV: 5 -0.902811175971E+03 0.10966E-04 -0.90931E-05 1576 0.152E-02 0.898E-03
DAV: 6 -0.902811177478E+03 -0.15071E-05 -0.22461E-05 1080 0.745E-03
173 F= -.90281118E+03 E0= -.90284064E+03 d E =-.322031E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902811179343E+03 -0.33719E-05 -0.17915E-03 1568 0.579E-02 0.996E-03
DAV: 2 -0.902811182971E+03 -0.36286E-05 -0.38879E-05 1136 0.847E-03
174 F= -.90281118E+03 E0= -.90284059E+03 d E =-.327524E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902811224368E+03 -0.45026E-04 -0.98386E-02 1536 0.485E-01 0.775E-02
DAV: 2 -0.902811473311E+03 -0.24894E-03 -0.28028E-03 1840 0.769E-02 0.428E-02
DAV: 3 -0.902811463464E+03 0.98470E-05 -0.77962E-05 1696 0.155E-02
175 F= -.90281146E+03 E0= -.90284106E+03 d E =-.280493E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.902811475923E+03 -0.26116E-05 -0.15470E-02 1536 0.192E-01 0.486E-02
DAV: 2 -0.902811553423E+03 -0.77500E-04 -0.48220E-04 1872 0.345E-02 0.599E-02
DAV: 3 -0.902811486149E+03 0.67273E-04 -0.10681E-04 1680 0.178E-02 0.228E-02
DAV: 4 -0.902811486260E+03 -0.11106E-06 -0.17956E-05 1184 0.715E-03
176 F= -.90281149E+03 E0= -.90284096E+03 d E =-.303289E-03