N E dE d eps ncg rms rms(c)
DAV: 1 0.147914465085E+04 0.14791E+04 -0.18958E+04 222 0.520E+02
DAV: 2 0.724564959812E+03 -0.75458E+03 -0.73183E+03 327 0.887E+01
DAV: 3 0.105802705311E+02 -0.71398E+03 -0.67897E+03 282 0.106E+02
DAV: 4 -0.275758469035E+03 -0.28634E+03 -0.28273E+03 246 0.859E+01
DAV: 5 -0.309906791584E+03 -0.34148E+02 -0.33925E+02 219 0.331E+01 0.267E+01
DAV: 6 -0.292785113057E+03 0.17122E+02 -0.48568E+01 237 0.205E+01 0.150E+01
DAV: 7 -0.289312845145E+03 0.34723E+01 -0.13210E+01 246 0.119E+01 0.754E+00
DAV: 8 -0.288466647325E+03 0.84620E+00 -0.30258E+00 228 0.559E+00 0.281E+00
DAV: 9 -0.288378472243E+03 0.88175E-01 -0.40580E-01 246 0.216E+00 0.103E+00
DAV: 10 -0.288360907700E+03 0.17565E-01 -0.80292E-02 228 0.105E+00 0.371E-01
DAV: 11 -0.288357839816E+03 0.30679E-02 -0.17563E-02 228 0.477E-01 0.242E-01
DAV: 12 -0.288360602446E+03 -0.27626E-02 -0.58632E-03 228 0.283E-01 0.164E-01
DAV: 13 -0.288367789590E+03 -0.71871E-02 -0.33531E-03 228 0.224E-01 0.103E-01
DAV: 14 -0.288380624787E+03 -0.12835E-01 -0.38156E-03 228 0.219E-01 0.566E-02
DAV: 15 -0.288389559523E+03 -0.89347E-02 -0.16636E-03 237 0.131E-01 0.423E-02
DAV: 16 -0.288396434869E+03 -0.68753E-02 -0.34656E-04 255 0.533E-02 0.285E-02
DAV: 17 -0.288404640964E+03 -0.82061E-02 -0.45780E-04 228 0.435E-02 0.180E-02
DAV: 18 -0.288408285249E+03 -0.36443E-02 -0.11172E-04 210 0.222E-02 0.121E-02
DAV: 19 -0.288411818127E+03 -0.35329E-02 -0.14677E-04 201 0.225E-02 0.678E-03
DAV: 20 -0.288413300735E+03 -0.14826E-02 -0.41917E-05 192 0.134E-02 0.462E-03
DAV: 21 -0.288414402478E+03 -0.11017E-02 -0.38847E-05 210 0.135E-02 0.294E-03
DAV: 22 -0.288414812097E+03 -0.40962E-03 -0.70341E-06 156 0.693E-03 0.181E-03
DAV: 23 -0.288415065738E+03 -0.25364E-03 -0.36194E-06 147 0.447E-03 0.113E-03
DAV: 24 -0.288415172877E+03 -0.10714E-03 -0.17707E-06 147 0.278E-03 0.850E-04
DAV: 25 -0.288415246043E+03 -0.73165E-04 -0.88363E-07 147 0.216E-03 0.434E-04
DAV: 26 -0.288415285876E+03 -0.39833E-04 -0.53620E-07 138 0.154E-03 0.279E-04
DAV: 27 -0.288415302019E+03 -0.16144E-04 -0.22372E-07 156 0.989E-04 0.172E-04
DAV: 28 -0.288415314398E+03 -0.12379E-04 -0.13206E-07 120 0.742E-04 0.976E-05
DAV: 29 -0.288415318892E+03 -0.44943E-05 -0.59254E-08 147 0.489E-04
1 F= -.28841532E+03 E0= -.28842414E+03 d E =-.288415E+03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.193112559221E+03 0.95303E+02 -0.39385E+03 192 0.202E+02 0.383E+01
DAV: 2 -0.218831417966E+03 -0.25719E+02 -0.31321E+02 246 0.516E+01 0.166E+01
DAV: 3 -0.213992301899E+03 0.48391E+01 -0.12701E+01 228 0.138E+01 0.788E+00
DAV: 4 -0.212726430181E+03 0.12659E+01 -0.54294E+00 246 0.810E+00 0.174E+00
DAV: 5 -0.212679681098E+03 0.46749E-01 -0.76548E-01 246 0.313E+00 0.121E+00
DAV: 6 -0.212665731159E+03 0.13950E-01 -0.88885E-02 237 0.101E+00 0.557E-01
DAV: 7 -0.212661570339E+03 0.41608E-02 -0.16986E-02 228 0.459E-01 0.248E-01
DAV: 8 -0.212665183232E+03 -0.36129E-02 -0.76871E-03 228 0.355E-01 0.126E-01
DAV: 9 -0.212672748566E+03 -0.75653E-02 -0.42515E-03 246 0.222E-01 0.835E-02
DAV: 10 -0.212680628109E+03 -0.78795E-02 -0.15118E-03 237 0.122E-01 0.478E-02
DAV: 11 -0.212687563830E+03 -0.69357E-02 -0.74372E-04 237 0.715E-02 0.307E-02
DAV: 12 -0.212693993686E+03 -0.64299E-02 -0.66065E-04 237 0.627E-02 0.186E-02
DAV: 13 -0.212697537144E+03 -0.35435E-02 -0.26012E-04 246 0.397E-02 0.118E-02
DAV: 14 -0.212699372139E+03 -0.18350E-02 -0.75545E-05 228 0.223E-02 0.758E-03
DAV: 15 -0.212700370199E+03 -0.99806E-03 -0.22771E-05 174 0.124E-02 0.549E-03
DAV: 16 -0.212701056107E+03 -0.68591E-03 -0.18169E-05 183 0.111E-02 0.289E-03
DAV: 17 -0.212701388640E+03 -0.33253E-03 -0.56932E-06 165 0.623E-03 0.171E-03
DAV: 18 -0.212701572387E+03 -0.18375E-03 -0.37718E-06 156 0.474E-03 0.943E-04
DAV: 19 -0.212701685125E+03 -0.11274E-03 -0.22881E-06 156 0.332E-03 0.470E-04
DAV: 20 -0.212701715956E+03 -0.30831E-04 -0.75844E-07 156 0.186E-03 0.366E-04
DAV: 21 -0.212701745373E+03 -0.29417E-04 -0.52641E-07 138 0.148E-03 0.266E-04
DAV: 22 -0.212701752867E+03 -0.74947E-05 -0.17489E-07 147 0.872E-04
2 F= -.21270175E+03 E0= -.21270564E+03 d E =0.757136E+02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.282341968718E+03 -0.69640E+02 -0.36849E+03 192 0.195E+02 0.260E+01
DAV: 2 -0.296988848066E+03 -0.14647E+02 -0.27468E+02 216 0.449E+01 0.216E+01
DAV: 3 -0.290645535872E+03 0.63433E+01 -0.18232E+01 237 0.153E+01 0.128E+01
DAV: 4 -0.289669816484E+03 0.97572E+00 -0.21059E+01 228 0.140E+01 0.737E+00
DAV: 5 -0.289031023969E+03 0.63879E+00 -0.61319E+00 237 0.812E+00 0.230E+00
DAV: 6 -0.289045395395E+03 -0.14371E-01 -0.65328E-01 237 0.285E+00 0.958E-01
DAV: 7 -0.289053770848E+03 -0.83755E-02 -0.85844E-02 255 0.887E-01 0.559E-01
DAV: 8 -0.289056616447E+03 -0.28456E-02 -0.11562E-02 246 0.357E-01 0.264E-01
DAV: 9 -0.289062309538E+03 -0.56931E-02 -0.76773E-03 246 0.283E-01 0.143E-01
DAV: 10 -0.289065885012E+03 -0.35755E-02 -0.10566E-03 237 0.111E-01 0.109E-01
DAV: 11 -0.289069283675E+03 -0.33987E-02 -0.93128E-04 264 0.986E-02 0.520E-02
DAV: 12 -0.289073319296E+03 -0.40356E-02 -0.93498E-04 255 0.953E-02 0.428E-02
DAV: 13 -0.289074870803E+03 -0.15515E-02 -0.16215E-04 237 0.405E-02 0.375E-02
DAV: 14 -0.289077106570E+03 -0.22358E-02 -0.25344E-04 237 0.374E-02 0.165E-02
DAV: 15 -0.289078864537E+03 -0.17580E-02 -0.26624E-04 228 0.366E-02 0.134E-02
DAV: 16 -0.289079423628E+03 -0.55909E-03 -0.29663E-05 219 0.162E-02 0.784E-03
DAV: 17 -0.289080061886E+03 -0.63826E-03 -0.16738E-05 174 0.130E-02 0.455E-03
DAV: 18 -0.289080327138E+03 -0.26525E-03 -0.56605E-06 165 0.720E-03 0.388E-03
DAV: 19 -0.289080485174E+03 -0.15804E-03 -0.27058E-06 147 0.476E-03 0.168E-03
DAV: 20 -0.289080624103E+03 -0.13893E-03 -0.29728E-06 156 0.373E-03 0.102E-03
DAV: 21 -0.289080697607E+03 -0.73504E-04 -0.12372E-06 147 0.241E-03 0.562E-04
DAV: 22 -0.289080738418E+03 -0.40811E-04 -0.73926E-07 147 0.168E-03 0.411E-04
DAV: 23 -0.289080764830E+03 -0.26411E-04 -0.40614E-07 147 0.136E-03 0.212E-04
DAV: 24 -0.289080774031E+03 -0.92010E-05 -0.17476E-07 147 0.914E-04
3 F= -.28908077E+03 E0= -.28908961E+03 d E =-.665455E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.289574361311E+03 -0.49360E+00 -0.52472E+00 192 0.751E+00 0.660E-01
DAV: 2 -0.289588351016E+03 -0.13990E-01 -0.19107E-01 228 0.118E+00 0.326E-01
DAV: 3 -0.289586900859E+03 0.14502E-02 -0.45152E-03 228 0.254E-01 0.188E-01
DAV: 4 -0.289587296977E+03 -0.39612E-03 -0.27796E-03 228 0.171E-01 0.580E-02
DAV: 5 -0.289587350151E+03 -0.53174E-04 -0.27589E-04 237 0.571E-02 0.259E-02
DAV: 6 -0.289587383676E+03 -0.33524E-04 -0.47654E-05 228 0.252E-02 0.106E-02
DAV: 7 -0.289587427665E+03 -0.43989E-04 -0.77971E-06 147 0.120E-02 0.517E-03
DAV: 8 -0.289587474012E+03 -0.46347E-04 -0.40779E-06 129 0.716E-03 0.272E-03
DAV: 9 -0.289587521150E+03 -0.47138E-04 -0.27232E-06 138 0.552E-03 0.185E-03
DAV: 10 -0.289587579909E+03 -0.58759E-04 -0.40530E-06 147 0.572E-03 0.111E-03
DAV: 11 -0.289587610895E+03 -0.30986E-04 -0.17326E-06 138 0.359E-03 0.761E-04
DAV: 12 -0.289587639209E+03 -0.28314E-04 -0.14462E-06 129 0.283E-03 0.488E-04
DAV: 13 -0.289587656907E+03 -0.17698E-04 -0.85753E-07 138 0.210E-03 0.371E-04
DAV: 14 -0.289587663120E+03 -0.62136E-05 -0.36807E-07 156 0.133E-03
4 F= -.28958766E+03 E0= -.28959653E+03 d E =-.117234E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.289723962523E+03 -0.13631E+00 -0.27318E+02 189 0.547E+01 0.583E+00
DAV: 2 -0.290535490955E+03 -0.81153E+00 -0.10355E+01 228 0.888E+00 0.279E+00
DAV: 3 -0.290403202054E+03 0.13229E+00 -0.36371E-01 228 0.217E+00 0.140E+00
DAV: 4 -0.290376600011E+03 0.26602E-01 -0.13603E-01 246 0.137E+00 0.451E-01
DAV: 5 -0.290377440768E+03 -0.84076E-03 -0.24735E-02 237 0.585E-01 0.201E-01
DAV: 6 -0.290377661208E+03 -0.22044E-03 -0.33692E-03 255 0.225E-01 0.924E-02
DAV: 7 -0.290378495467E+03 -0.83426E-03 -0.65422E-04 219 0.143E-01 0.524E-02
DAV: 8 -0.290379590156E+03 -0.10947E-02 -0.24416E-04 237 0.949E-02 0.249E-02
DAV: 9 -0.290380653695E+03 -0.10635E-02 -0.21215E-04 246 0.734E-02 0.191E-02
DAV: 10 -0.290381865537E+03 -0.12118E-02 -0.11814E-04 255 0.582E-02 0.962E-03
DAV: 11 -0.290382576016E+03 -0.71048E-03 -0.79494E-05 219 0.384E-02 0.718E-03
DAV: 12 -0.290383040216E+03 -0.46420E-03 -0.22183E-05 192 0.180E-02 0.524E-03
DAV: 13 -0.290383480901E+03 -0.44068E-03 -0.14394E-05 165 0.118E-02 0.286E-03
DAV: 14 -0.290383782327E+03 -0.30143E-03 -0.10135E-05 165 0.929E-03 0.214E-03
DAV: 15 -0.290383961138E+03 -0.17881E-03 -0.46051E-06 165 0.616E-03 0.123E-03
DAV: 16 -0.290384063897E+03 -0.10276E-03 -0.27256E-06 147 0.360E-03 0.939E-04
DAV: 17 -0.290384123085E+03 -0.59189E-04 -0.12233E-06 147 0.306E-03 0.542E-04
DAV: 18 -0.290384154216E+03 -0.31131E-04 -0.77687E-07 147 0.212E-03 0.451E-04
DAV: 19 -0.290384168657E+03 -0.14440E-04 -0.29614E-07 147 0.139E-03 0.191E-04
DAV: 20 -0.290384182281E+03 -0.13625E-04 -0.24365E-07 147 0.103E-03 0.187E-04
DAV: 21 -0.290384186729E+03 -0.44482E-05 -0.90141E-08 147 0.750E-04
5 F= -.29038419E+03 E0= -.29038812E+03 d E =-.196887E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.290671443620E+03 -0.28726E+00 -0.57465E+01 186 0.249E+01 0.256E+00
DAV: 2 -0.290811317842E+03 -0.13987E+00 -0.23017E+00 243 0.420E+00 0.137E+00
DAV: 3 -0.290778860306E+03 0.32458E-01 -0.73885E-02 237 0.110E+00 0.752E-01
DAV: 4 -0.290777987237E+03 0.87307E-03 -0.48230E-02 228 0.717E-01 0.281E-01
DAV: 5 -0.290778452185E+03 -0.46495E-03 -0.57950E-03 228 0.251E-01 0.108E-01
DAV: 6 -0.290779018822E+03 -0.56664E-03 -0.80822E-04 237 0.103E-01 0.434E-02
DAV: 7 -0.290779561617E+03 -0.54280E-03 -0.13355E-04 237 0.428E-02 0.198E-02
DAV: 8 -0.290780004137E+03 -0.44252E-03 -0.59215E-05 210 0.319E-02 0.103E-02
DAV: 9 -0.290780297522E+03 -0.29339E-03 -0.33343E-05 210 0.231E-02 0.745E-03
DAV: 10 -0.290780623281E+03 -0.32576E-03 -0.32470E-05 201 0.252E-02 0.493E-03
DAV: 11 -0.290780823027E+03 -0.19975E-03 -0.27512E-05 210 0.222E-02 0.378E-03
DAV: 12 -0.290780939909E+03 -0.11688E-03 -0.14075E-05 165 0.188E-02 0.302E-03
DAV: 13 -0.290781008316E+03 -0.68407E-04 -0.92770E-06 165 0.137E-02 0.234E-03
DAV: 14 -0.290781039971E+03 -0.31655E-04 -0.42010E-06 156 0.877E-03 0.168E-03
DAV: 15 -0.290781063537E+03 -0.23565E-04 -0.18933E-06 147 0.635E-03 0.126E-03
DAV: 16 -0.290781093660E+03 -0.30124E-04 -0.32964E-06 156 0.112E-02 0.112E-03
DAV: 17 -0.290781097577E+03 -0.39166E-05 -0.28299E-06 156 0.509E-03
6 F= -.29078110E+03 E0= -.29078635E+03 d E =-.236578E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.290819902505E+03 -0.38809E-01 -0.26381E+00 189 0.538E+00 0.531E-01
DAV: 2 -0.290826006758E+03 -0.61043E-02 -0.97047E-02 228 0.882E-01 0.271E-01
DAV: 3 -0.290824895321E+03 0.11114E-02 -0.31895E-03 204 0.221E-01 0.140E-01
DAV: 4 -0.290824907773E+03 -0.12452E-04 -0.18109E-03 237 0.147E-01 0.479E-02
DAV: 5 -0.290824919618E+03 -0.11844E-04 -0.25330E-04 228 0.580E-02 0.189E-02
DAV: 6 -0.290824939777E+03 -0.20159E-04 -0.28856E-05 210 0.228E-02 0.928E-03
DAV: 7 -0.290824969442E+03 -0.29665E-04 -0.39438E-06 147 0.128E-02 0.493E-03
DAV: 8 -0.290825011906E+03 -0.42465E-04 -0.62892E-06 138 0.161E-02 0.268E-03
DAV: 9 -0.290825047757E+03 -0.35850E-04 -0.73360E-06 147 0.138E-02 0.217E-03
DAV: 10 -0.290825074831E+03 -0.27074E-04 -0.40622E-06 129 0.982E-03 0.150E-03
DAV: 11 -0.290825101614E+03 -0.26783E-04 -0.30570E-06 156 0.864E-03 0.854E-04
DAV: 12 -0.290825122334E+03 -0.20719E-04 -0.19236E-06 129 0.642E-03 0.570E-04
DAV: 13 -0.290825134602E+03 -0.12269E-04 -0.11745E-06 147 0.388E-03 0.457E-04
DAV: 14 -0.290825142731E+03 -0.81283E-05 -0.51934E-07 138 0.230E-03
7 F= -.29082514E+03 E0= -.29082963E+03 d E =-.240982E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.290826132813E+03 -0.99821E-03 -0.96609E-02 192 0.103E+00 0.102E-01
DAV: 2 -0.290826361184E+03 -0.22837E-03 -0.35955E-03 228 0.169E-01 0.529E-02
DAV: 3 -0.290826321248E+03 0.39936E-04 -0.12015E-04 219 0.427E-02 0.272E-02
DAV: 4 -0.290826320318E+03 0.93049E-06 -0.67626E-05 219 0.275E-02
8 F= -.29082632E+03 E0= -.29083075E+03 d E =-.241100E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.291089019628E+03 -0.26270E+00 -0.23253E+02 189 0.553E+01 0.417E+00
DAV: 2 -0.291627834858E+03 -0.53882E+00 -0.69773E+00 210 0.861E+00 0.273E+00
DAV: 3 -0.291552347416E+03 0.75487E-01 -0.28090E-01 246 0.216E+00 0.158E+00
DAV: 4 -0.291561344736E+03 -0.89973E-02 -0.14617E-01 225 0.131E+00 0.577E-01
DAV: 5 -0.291565211596E+03 -0.38669E-02 -0.13967E-02 246 0.500E-01 0.249E-01
DAV: 6 -0.291565779323E+03 -0.56773E-03 -0.39241E-03 237 0.224E-01 0.114E-01
DAV: 7 -0.291566109769E+03 -0.33045E-03 -0.54532E-04 219 0.820E-02 0.517E-02
DAV: 8 -0.291566417954E+03 -0.30819E-03 -0.13557E-04 228 0.427E-02 0.216E-02
DAV: 9 -0.291566758934E+03 -0.34098E-03 -0.70200E-05 237 0.290E-02 0.100E-02
DAV: 10 -0.291567133847E+03 -0.37491E-03 -0.18420E-05 174 0.148E-02 0.674E-03
DAV: 11 -0.291567408966E+03 -0.27512E-03 -0.15720E-05 192 0.101E-02 0.414E-03
DAV: 12 -0.291567671361E+03 -0.26240E-03 -0.12913E-05 168 0.844E-03 0.222E-03
DAV: 13 -0.291567795964E+03 -0.12460E-03 -0.51279E-06 165 0.536E-03 0.174E-03
DAV: 14 -0.291567896127E+03 -0.10016E-03 -0.48151E-06 141 0.470E-03 0.101E-03
DAV: 15 -0.291567943926E+03 -0.47800E-04 -0.17518E-06 147 0.303E-03 0.488E-04
DAV: 16 -0.291567971486E+03 -0.27560E-04 -0.10940E-06 141 0.204E-03 0.379E-04
DAV: 17 -0.291567987434E+03 -0.15948E-04 -0.53619E-07 147 0.147E-03 0.299E-04
DAV: 18 -0.291567996861E+03 -0.94273E-05 -0.28901E-07 141 0.106E-03
9 F= -.29156800E+03 E0= -.29157219E+03 d E =-.741677E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.291584080452E+03 -0.16093E-01 -0.54531E+00 186 0.838E+00 0.666E-01
DAV: 2 -0.291596116244E+03 -0.12036E-01 -0.18143E-01 225 0.136E+00 0.442E-01
DAV: 3 -0.291594106462E+03 0.20098E-02 -0.79397E-03 237 0.362E-01 0.248E-01
DAV: 4 -0.291595144827E+03 -0.10384E-02 -0.41321E-03 204 0.220E-01 0.987E-02
DAV: 5 -0.291595243821E+03 -0.98993E-04 -0.50624E-04 228 0.911E-02 0.386E-02
DAV: 6 -0.291595268821E+03 -0.25000E-04 -0.10649E-04 237 0.358E-02 0.175E-02
DAV: 7 -0.291595286345E+03 -0.17525E-04 -0.10025E-05 120 0.122E-02 0.801E-03
DAV: 8 -0.291595304371E+03 -0.18025E-04 -0.52014E-06 147 0.810E-03 0.327E-03
DAV: 9 -0.291595320024E+03 -0.15654E-04 -0.27543E-06 129 0.582E-03 0.148E-03
DAV: 10 -0.291595336720E+03 -0.16695E-04 -0.15198E-06 147 0.387E-03 0.130E-03
DAV: 11 -0.291595350692E+03 -0.13973E-04 -0.99192E-07 132 0.257E-03 0.917E-04
DAV: 12 -0.291595365324E+03 -0.14631E-04 -0.10499E-06 144 0.254E-03 0.428E-04
DAV: 13 -0.291595374821E+03 -0.94976E-05 -0.70749E-07 141 0.183E-03
10 F= -.29159537E+03 E0= -.29159963E+03 d E =-.769055E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.291051000787E+03 0.54436E+00 -0.21483E+02 186 0.511E+01 0.419E+00
DAV: 2 -0.291538551956E+03 -0.48755E+00 -0.65712E+00 246 0.806E+00 0.258E+00
DAV: 3 -0.291462079446E+03 0.76473E-01 -0.24563E-01 234 0.205E+00 0.153E+00
DAV: 4 -0.291458501091E+03 0.35784E-02 -0.14466E-01 237 0.137E+00 0.538E-01
DAV: 5 -0.291462423902E+03 -0.39228E-02 -0.18396E-02 246 0.528E-01 0.236E-01
DAV: 6 -0.291462577278E+03 -0.15338E-03 -0.38605E-03 228 0.218E-01 0.113E-01
DAV: 7 -0.291462799447E+03 -0.22217E-03 -0.63209E-04 237 0.981E-02 0.538E-02
DAV: 8 -0.291463262617E+03 -0.46317E-03 -0.12843E-04 237 0.560E-02 0.194E-02
DAV: 9 -0.291463640633E+03 -0.37802E-03 -0.65269E-05 237 0.369E-02 0.130E-02
DAV: 10 -0.291464125404E+03 -0.48477E-03 -0.35831E-05 183 0.312E-02 0.710E-03
DAV: 11 -0.291464571655E+03 -0.44625E-03 -0.43738E-05 201 0.298E-02 0.469E-03
DAV: 12 -0.291464946282E+03 -0.37463E-03 -0.37699E-05 183 0.242E-02 0.281E-03
DAV: 13 -0.291465087578E+03 -0.14130E-03 -0.91745E-06 165 0.106E-02 0.244E-03
DAV: 14 -0.291465137718E+03 -0.50140E-04 -0.18669E-06 156 0.417E-03 0.167E-03
DAV: 15 -0.291465264814E+03 -0.12710E-03 -0.59033E-06 144 0.534E-03 0.126E-03
DAV: 16 -0.291465278094E+03 -0.13279E-04 -0.98494E-07 156 0.270E-03 0.913E-04
DAV: 17 -0.291465311650E+03 -0.33556E-04 -0.93617E-07 144 0.264E-03 0.540E-04
DAV: 18 -0.291465337443E+03 -0.25794E-04 -0.67318E-07 144 0.182E-03 0.426E-04
DAV: 19 -0.291465347526E+03 -0.10082E-04 -0.25026E-07 147 0.110E-03 0.250E-04
DAV: 20 -0.291465356848E+03 -0.93227E-05 -0.15910E-07 141 0.105E-03
11 F= -.29146536E+03 E0= -.29146978E+03 d E =0.130018E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.291701539900E+03 -0.23619E+00 -0.63713E+01 186 0.279E+01 0.230E+00
DAV: 2 -0.291854869632E+03 -0.15333E+00 -0.22855E+00 216 0.460E+00 0.155E+00
DAV: 3 -0.291828954502E+03 0.25915E-01 -0.86289E-02 228 0.122E+00 0.956E-01
DAV: 4 -0.291831708608E+03 -0.27541E-02 -0.64718E-02 237 0.933E-01 0.372E-01
DAV: 5 -0.291832716131E+03 -0.10075E-02 -0.93160E-03 237 0.380E-01 0.168E-01
DAV: 6 -0.291832948420E+03 -0.23229E-03 -0.17584E-03 228 0.147E-01 0.635E-02
DAV: 7 -0.291833064964E+03 -0.11654E-03 -0.21384E-04 255 0.595E-02 0.292E-02
DAV: 8 -0.291833212187E+03 -0.14722E-03 -0.48567E-05 219 0.301E-02 0.146E-02
DAV: 9 -0.291833345513E+03 -0.13333E-03 -0.23071E-05 210 0.213E-02 0.713E-03
DAV: 10 -0.291833525160E+03 -0.17965E-03 -0.14626E-05 174 0.199E-02 0.504E-03
DAV: 11 -0.291833661898E+03 -0.13674E-03 -0.10904E-05 165 0.158E-02 0.390E-03
DAV: 12 -0.291833770463E+03 -0.10856E-03 -0.85434E-06 159 0.123E-02 0.215E-03
DAV: 13 -0.291833863568E+03 -0.93106E-04 -0.52273E-06 165 0.853E-03 0.107E-03
DAV: 14 -0.291833911675E+03 -0.48107E-04 -0.26440E-06 141 0.502E-03 0.837E-04
DAV: 15 -0.291833944580E+03 -0.32905E-04 -0.15883E-06 147 0.321E-03 0.378E-04
DAV: 16 -0.291833963879E+03 -0.19299E-04 -0.81191E-07 150 0.208E-03 0.255E-04
DAV: 17 -0.291833973862E+03 -0.99833E-05 -0.38307E-07 138 0.139E-03
12 F= -.29183397E+03 E0= -.29183855E+03 d E =-.238599E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.291553665818E+03 0.28030E+00 -0.13498E+02 186 0.412E+01 0.296E+00
DAV: 2 -0.291818566627E+03 -0.26490E+00 -0.38040E+00 225 0.598E+00 0.186E+00
DAV: 3 -0.291774844438E+03 0.43722E-01 -0.13653E-01 246 0.155E+00 0.107E+00
DAV: 4 -0.291776730399E+03 -0.18860E-02 -0.10331E-01 228 0.119E+00 0.351E-01
DAV: 5 -0.291778052009E+03 -0.13216E-02 -0.16374E-02 219 0.469E-01 0.190E-01
DAV: 6 -0.291778172834E+03 -0.12083E-03 -0.26255E-03 228 0.189E-01 0.859E-02
DAV: 7 -0.291778318432E+03 -0.14560E-03 -0.69590E-04 219 0.113E-01 0.392E-02
DAV: 8 -0.291778510997E+03 -0.19256E-03 -0.98502E-05 228 0.429E-02 0.181E-02
DAV: 9 -0.291778737084E+03 -0.22609E-03 -0.54166E-05 228 0.338E-02 0.930E-03
DAV: 10 -0.291779011606E+03 -0.27452E-03 -0.21656E-05 192 0.286E-02 0.680E-03
DAV: 11 -0.291779292372E+03 -0.28077E-03 -0.25852E-05 210 0.274E-02 0.398E-03
DAV: 12 -0.291779569224E+03 -0.27685E-03 -0.24685E-05 201 0.274E-02 0.288E-03
DAV: 13 -0.291779719853E+03 -0.15063E-03 -0.17053E-05 174 0.160E-02 0.240E-03
DAV: 14 -0.291779749430E+03 -0.29577E-04 -0.28514E-06 156 0.570E-03 0.231E-03
DAV: 15 -0.291779774619E+03 -0.25189E-04 -0.87899E-07 138 0.287E-03 0.163E-03
DAV: 16 -0.291779841734E+03 -0.67115E-04 -0.23454E-06 156 0.376E-03 0.995E-04
DAV: 17 -0.291779863404E+03 -0.21670E-04 -0.61429E-07 147 0.189E-03 0.925E-04
DAV: 18 -0.291779880402E+03 -0.16998E-04 -0.57077E-07 147 0.229E-03 0.517E-04
DAV: 19 -0.291779893309E+03 -0.12907E-04 -0.38684E-07 147 0.145E-03 0.441E-04
DAV: 20 -0.291779899936E+03 -0.66269E-05 -0.26195E-07 147 0.150E-03
13 F= -.29177990E+03 E0= -.29178442E+03 d E =0.540739E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.291916378889E+03 -0.13649E+00 -0.37979E+01 186 0.219E+01 0.167E+00
DAV: 2 -0.291994429409E+03 -0.78051E-01 -0.12355E+00 228 0.334E+00 0.108E+00
DAV: 3 -0.291979902247E+03 0.14527E-01 -0.45181E-02 246 0.886E-01 0.653E-01
DAV: 4 -0.291981901363E+03 -0.19991E-02 -0.36735E-02 237 0.705E-01 0.245E-01
DAV: 5 -0.291982359243E+03 -0.45788E-03 -0.61128E-03 228 0.301E-01 0.117E-01
DAV: 6 -0.291982517069E+03 -0.15783E-03 -0.12072E-03 219 0.127E-01 0.539E-02
DAV: 7 -0.291982586358E+03 -0.69289E-04 -0.25407E-04 255 0.687E-02 0.225E-02
DAV: 8 -0.291982670620E+03 -0.84262E-04 -0.39132E-05 219 0.261E-02 0.122E-02
DAV: 9 -0.291982743220E+03 -0.72601E-04 -0.16206E-05 183 0.189E-02 0.510E-03
DAV: 10 -0.291982843937E+03 -0.10072E-03 -0.11655E-05 165 0.171E-02 0.392E-03
DAV: 11 -0.291982924671E+03 -0.80734E-04 -0.70048E-06 165 0.134E-02 0.293E-03
DAV: 12 -0.291983009490E+03 -0.84819E-04 -0.70617E-06 156 0.137E-02 0.136E-03
DAV: 13 -0.291983060510E+03 -0.51020E-04 -0.65232E-06 165 0.985E-03 0.111E-03
DAV: 14 -0.291983076482E+03 -0.15972E-04 -0.20085E-06 156 0.445E-03 0.984E-04
DAV: 15 -0.291983087284E+03 -0.10802E-04 -0.73916E-07 156 0.220E-03 0.663E-04
DAV: 16 -0.291983107579E+03 -0.20295E-04 -0.77955E-07 156 0.223E-03 0.446E-04
DAV: 17 -0.291983112994E+03 -0.54147E-05 -0.29523E-07 156 0.126E-03
14 F= -.29198311E+03 E0= -.29198770E+03 d E =-.149139E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.291973705106E+03 0.94025E-02 -0.27679E+01 186 0.192E+01 0.120E+00
DAV: 2 -0.292001699773E+03 -0.27995E-01 -0.58422E-01 234 0.252E+00 0.778E-01
DAV: 3 -0.291998450701E+03 0.32491E-02 -0.32196E-02 246 0.663E-01 0.477E-01
DAV: 4 -0.291998332534E+03 0.11817E-03 -0.80677E-03 237 0.326E-01 0.180E-01
DAV: 5 -0.291998511792E+03 -0.17926E-03 -0.15148E-03 228 0.159E-01 0.552E-02
DAV: 6 -0.291998611196E+03 -0.99404E-04 -0.40548E-04 237 0.703E-02 0.343E-02
DAV: 7 -0.291998752258E+03 -0.14106E-03 -0.70962E-05 219 0.296E-02 0.151E-02
DAV: 8 -0.291998912829E+03 -0.16057E-03 -0.18267E-05 192 0.153E-02 0.718E-03
DAV: 9 -0.291999100915E+03 -0.18809E-03 -0.19381E-05 186 0.130E-02 0.478E-03
DAV: 10 -0.291999288537E+03 -0.18762E-03 -0.15971E-05 180 0.102E-02 0.253E-03
DAV: 11 -0.291999401492E+03 -0.11296E-03 -0.92230E-06 174 0.729E-03 0.170E-03
DAV: 12 -0.291999463718E+03 -0.62226E-04 -0.28323E-06 165 0.419E-03 0.971E-04
DAV: 13 -0.291999524313E+03 -0.60595E-04 -0.51130E-06 162 0.387E-03 0.719E-04
DAV: 14 -0.291999538379E+03 -0.14066E-04 -0.51072E-07 156 0.180E-03 0.543E-04
DAV: 15 -0.291999556972E+03 -0.18593E-04 -0.61419E-07 141 0.155E-03 0.264E-04
DAV: 16 -0.291999565501E+03 -0.85290E-05 -0.22873E-07 147 0.983E-04
15 F= -.29199957E+03 E0= -.29200434E+03 d E =-.164525E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292038052041E+03 -0.38495E-01 -0.58633E+00 186 0.885E+00 0.556E-01
DAV: 2 -0.292043795126E+03 -0.57431E-02 -0.12369E-01 213 0.116E+00 0.359E-01
DAV: 3 -0.292043105844E+03 0.68928E-03 -0.67973E-03 246 0.307E-01 0.217E-01
DAV: 4 -0.292043138199E+03 -0.32355E-04 -0.18928E-03 219 0.158E-01 0.796E-02
DAV: 5 -0.292043151710E+03 -0.13510E-04 -0.30762E-04 228 0.723E-02 0.267E-02
DAV: 6 -0.292043167644E+03 -0.15935E-04 -0.91468E-05 237 0.343E-02 0.152E-02
DAV: 7 -0.292043200586E+03 -0.32942E-04 -0.16420E-05 165 0.152E-02 0.649E-03
DAV: 8 -0.292043237560E+03 -0.36974E-04 -0.39575E-06 147 0.750E-03 0.325E-03
DAV: 9 -0.292043285845E+03 -0.48285E-04 -0.40668E-06 147 0.595E-03 0.205E-03
DAV: 10 -0.292043341199E+03 -0.55355E-04 -0.36128E-06 150 0.482E-03 0.123E-03
DAV: 11 -0.292043382618E+03 -0.41418E-04 -0.33828E-06 171 0.381E-03 0.714E-04
DAV: 12 -0.292043404776E+03 -0.22158E-04 -0.85684E-07 156 0.213E-03 0.471E-04
DAV: 13 -0.292043422738E+03 -0.17962E-04 -0.63670E-07 132 0.163E-03 0.317E-04
DAV: 14 -0.292043430358E+03 -0.76196E-05 -0.31550E-07 174 0.108E-03
16 F= -.29204343E+03 E0= -.29204811E+03 d E =-.603174E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292074527435E+03 -0.31105E-01 -0.15208E+01 186 0.142E+01 0.770E-01
DAV: 2 -0.292093923413E+03 -0.19396E-01 -0.27957E-01 213 0.168E+00 0.513E-01
DAV: 3 -0.292092571342E+03 0.13521E-02 -0.92993E-03 237 0.377E-01 0.315E-01
DAV: 4 -0.292093238847E+03 -0.66751E-03 -0.51976E-03 219 0.295E-01 0.864E-02
DAV: 5 -0.292093324686E+03 -0.85839E-04 -0.10963E-03 228 0.125E-01 0.598E-02
DAV: 6 -0.292093334716E+03 -0.10030E-04 -0.18115E-04 237 0.470E-02 0.317E-02
DAV: 7 -0.292093362330E+03 -0.27614E-04 -0.31891E-05 192 0.243E-02 0.143E-02
DAV: 8 -0.292093403132E+03 -0.40802E-04 -0.13824E-05 165 0.168E-02 0.504E-03
DAV: 9 -0.292093446894E+03 -0.43762E-04 -0.91700E-06 165 0.127E-02 0.357E-03
DAV: 10 -0.292093496547E+03 -0.49653E-04 -0.36624E-06 156 0.901E-03 0.238E-03
DAV: 11 -0.292093554355E+03 -0.57808E-04 -0.53334E-06 165 0.874E-03 0.148E-03
DAV: 12 -0.292093599770E+03 -0.45415E-04 -0.28865E-06 165 0.606E-03 0.869E-04
DAV: 13 -0.292093623903E+03 -0.24134E-04 -0.14703E-06 141 0.353E-03 0.632E-04
DAV: 14 -0.292093639422E+03 -0.15518E-04 -0.94360E-07 156 0.267E-03 0.414E-04
DAV: 15 -0.292093654308E+03 -0.14887E-04 -0.69141E-07 132 0.180E-03 0.283E-04
DAV: 16 -0.292093660939E+03 -0.66303E-05 -0.34699E-07 156 0.141E-03
17 F= -.29209366E+03 E0= -.29209798E+03 d E =-.502306E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292093908013E+03 -0.25370E-03 -0.93086E-02 186 0.111E+00 0.619E-02
DAV: 2 -0.292094025069E+03 -0.11706E-03 -0.17394E-03 219 0.133E-01 0.404E-02
DAV: 3 -0.292094017816E+03 0.72526E-05 -0.56537E-05 213 0.300E-02
18 F= -.29209402E+03 E0= -.29209836E+03 d E =-.505875E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292136017167E+03 -0.41992E-01 -0.84438E+00 186 0.106E+01 0.645E-01
DAV: 2 -0.292146850367E+03 -0.10833E-01 -0.16621E-01 213 0.129E+00 0.410E-01
DAV: 3 -0.292146488763E+03 0.36160E-03 -0.57243E-03 237 0.286E-01 0.238E-01
DAV: 4 -0.292147157653E+03 -0.66889E-03 -0.27352E-03 204 0.221E-01 0.588E-02
DAV: 5 -0.292147209064E+03 -0.51411E-04 -0.60913E-04 228 0.887E-02 0.371E-02
DAV: 6 -0.292147213544E+03 -0.44800E-05 -0.14884E-04 210 0.435E-02 0.182E-02
DAV: 7 -0.292147225959E+03 -0.12415E-04 -0.27607E-05 201 0.212E-02 0.828E-03
DAV: 8 -0.292147241413E+03 -0.15454E-04 -0.46872E-06 138 0.875E-03 0.300E-03
DAV: 9 -0.292147253771E+03 -0.12358E-04 -0.21908E-06 147 0.491E-03 0.169E-03
DAV: 10 -0.292147265363E+03 -0.11592E-04 -0.10756E-06 147 0.284E-03 0.120E-03
DAV: 11 -0.292147278938E+03 -0.13575E-04 -0.12297E-06 129 0.277E-03 0.795E-04
DAV: 12 -0.292147289269E+03 -0.10331E-04 -0.13033E-06 147 0.350E-03 0.131E-03
DAV: 13 -0.292147292823E+03 -0.35533E-05 -0.51261E-07 156 0.185E-03
19 F= -.29214729E+03 E0= -.29215153E+03 d E =-.532750E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292153123819E+03 -0.58345E-02 -0.48177E+00 186 0.800E+00 0.490E-01
DAV: 2 -0.292159236858E+03 -0.61130E-02 -0.94520E-02 225 0.969E-01 0.312E-01
DAV: 3 -0.292158991620E+03 0.24524E-03 -0.31259E-03 225 0.211E-01 0.180E-01
DAV: 4 -0.292159376839E+03 -0.38522E-03 -0.15857E-03 207 0.165E-01 0.445E-02
DAV: 5 -0.292159403521E+03 -0.26682E-04 -0.33479E-04 228 0.664E-02 0.274E-02
DAV: 6 -0.292159409372E+03 -0.58517E-05 -0.87921E-05 210 0.331E-02
20 F= -.29215941E+03 E0= -.29216357E+03 d E =-.653916E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292171656269E+03 -0.12253E-01 -0.96752E+00 186 0.114E+01 0.776E-01
DAV: 2 -0.292185735742E+03 -0.14079E-01 -0.22950E-01 237 0.155E+00 0.469E-01
DAV: 3 -0.292185084001E+03 0.65174E-03 -0.10620E-02 237 0.382E-01 0.276E-01
DAV: 4 -0.292185446654E+03 -0.36265E-03 -0.25894E-03 204 0.216E-01 0.981E-02
DAV: 5 -0.292185609883E+03 -0.16323E-03 -0.55462E-04 237 0.873E-02 0.333E-02
DAV: 6 -0.292185645194E+03 -0.35311E-04 -0.10568E-04 228 0.375E-02 0.180E-02
DAV: 7 -0.292185689946E+03 -0.44752E-04 -0.15238E-05 156 0.156E-02 0.793E-03
DAV: 8 -0.292185736771E+03 -0.46825E-04 -0.85799E-06 165 0.106E-02 0.350E-03
DAV: 9 -0.292185773000E+03 -0.36230E-04 -0.25193E-06 156 0.666E-03 0.215E-03
DAV: 10 -0.292185806297E+03 -0.33296E-04 -0.18484E-06 138 0.422E-03 0.144E-03
DAV: 11 -0.292185845707E+03 -0.39410E-04 -0.22817E-06 165 0.387E-03 0.854E-04
DAV: 12 -0.292185872632E+03 -0.26925E-04 -0.15659E-06 147 0.269E-03 0.634E-04
DAV: 13 -0.292185891377E+03 -0.18745E-04 -0.12079E-06 156 0.196E-03 0.337E-04
DAV: 14 -0.292185903239E+03 -0.11863E-04 -0.65606E-07 147 0.149E-03 0.291E-04
DAV: 15 -0.292185909420E+03 -0.61807E-05 -0.33907E-07 147 0.101E-03
21 F= -.29218591E+03 E0= -.29218998E+03 d E =-.265000E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292187068303E+03 -0.11651E-02 -0.36930E-01 186 0.222E+00 0.153E-01
DAV: 2 -0.292187605084E+03 -0.53678E-03 -0.89384E-03 234 0.305E-01 0.922E-02
DAV: 3 -0.292187573239E+03 0.31845E-04 -0.41171E-04 210 0.761E-02 0.543E-02
DAV: 4 -0.292187584010E+03 -0.10771E-04 -0.11421E-04 204 0.450E-02 0.190E-02
DAV: 5 -0.292187587748E+03 -0.37383E-05 -0.21012E-05 171 0.178E-02
22 F= -.29218759E+03 E0= -.29219168E+03 d E =-.281784E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292202646030E+03 -0.15062E-01 -0.68211E+00 186 0.946E+00 0.598E-01
DAV: 2 -0.292212758245E+03 -0.10112E-01 -0.14418E-01 216 0.123E+00 0.387E-01
DAV: 3 -0.292211902526E+03 0.85572E-03 -0.53243E-03 234 0.297E-01 0.228E-01
DAV: 4 -0.292212119655E+03 -0.21713E-03 -0.26018E-03 216 0.207E-01 0.681E-02
DAV: 5 -0.292212176323E+03 -0.56668E-04 -0.47571E-04 237 0.813E-02 0.360E-02
DAV: 6 -0.292212189967E+03 -0.13644E-04 -0.14392E-04 219 0.432E-02 0.185E-02
DAV: 7 -0.292212200269E+03 -0.10302E-04 -0.26190E-05 192 0.205E-02 0.874E-03
DAV: 8 -0.292212218904E+03 -0.18636E-04 -0.56973E-06 138 0.877E-03 0.350E-03
DAV: 9 -0.292212233694E+03 -0.14790E-04 -0.22592E-06 147 0.567E-03 0.160E-03
DAV: 10 -0.292212248917E+03 -0.15223E-04 -0.16888E-06 147 0.453E-03 0.136E-03
DAV: 11 -0.292212261002E+03 -0.12085E-04 -0.93927E-07 138 0.273E-03 0.947E-04
DAV: 12 -0.292212270248E+03 -0.92455E-05 -0.72854E-07 147 0.235E-03
23 F= -.29221227E+03 E0= -.29221631E+03 d E =-.246825E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292212372040E+03 -0.11104E-03 -0.55957E-02 189 0.857E-01 0.540E-02
DAV: 2 -0.292212455448E+03 -0.83408E-04 -0.11939E-03 219 0.111E-01 0.351E-02
DAV: 3 -0.292212449520E+03 0.59271E-05 -0.43654E-05 225 0.271E-02
24 F= -.29221245E+03 E0= -.29221648E+03 d E =-.248618E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292229194025E+03 -0.16739E-01 -0.68212E+00 186 0.937E+00 0.603E-01
DAV: 2 -0.292239774007E+03 -0.10580E-01 -0.15237E-01 225 0.123E+00 0.361E-01
DAV: 3 -0.292239299126E+03 0.47488E-03 -0.42845E-03 204 0.277E-01 0.216E-01
DAV: 4 -0.292240005648E+03 -0.70652E-03 -0.35576E-03 216 0.236E-01 0.709E-02
DAV: 5 -0.292239977876E+03 0.27773E-04 -0.68236E-04 219 0.101E-01 0.404E-02
DAV: 6 -0.292239983486E+03 -0.56102E-05 -0.19984E-04 219 0.457E-02 0.187E-02
DAV: 7 -0.292239987776E+03 -0.42904E-05 -0.23040E-05 201 0.190E-02
25 F= -.29223999E+03 E0= -.29224400E+03 d E =-.275383E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292239595163E+03 0.38832E-03 -0.44650E+00 186 0.760E+00 0.486E-01
DAV: 2 -0.292246619409E+03 -0.70242E-02 -0.10041E-01 234 0.996E-01 0.291E-01
DAV: 3 -0.292246263037E+03 0.35637E-03 -0.28076E-03 207 0.224E-01 0.175E-01
DAV: 4 -0.292246718747E+03 -0.45571E-03 -0.23923E-03 207 0.193E-01 0.582E-02
DAV: 5 -0.292246701657E+03 0.17090E-04 -0.46197E-04 219 0.826E-02 0.334E-02
DAV: 6 -0.292246710152E+03 -0.84949E-05 -0.13974E-04 219 0.380E-02 0.151E-02
DAV: 7 -0.292246717914E+03 -0.77628E-05 -0.15091E-05 174 0.158E-02
26 F= -.29224672E+03 E0= -.29225071E+03 d E =-.342684E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292261421894E+03 -0.14712E-01 -0.29457E+00 186 0.612E+00 0.394E-01
DAV: 2 -0.292266210391E+03 -0.47885E-02 -0.67706E-02 225 0.806E-01 0.232E-01
DAV: 3 -0.292266171301E+03 0.39091E-04 -0.17159E-03 225 0.163E-01 0.139E-01
DAV: 4 -0.292266537191E+03 -0.36589E-03 -0.12985E-03 219 0.142E-01 0.417E-02
DAV: 5 -0.292266534548E+03 0.26435E-05 -0.20921E-04 219 0.583E-02 0.254E-02
DAV: 6 -0.292266542149E+03 -0.76011E-05 -0.10465E-04 219 0.370E-02 0.113E-02
DAV: 7 -0.292266548525E+03 -0.63766E-05 -0.14952E-05 183 0.154E-02
27 F= -.29226655E+03 E0= -.29227052E+03 d E =-.198306E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292261492021E+03 0.50501E-02 -0.12404E+01 186 0.126E+01 0.802E-01
DAV: 2 -0.292281484801E+03 -0.19993E-01 -0.28034E-01 225 0.162E+00 0.475E-01
DAV: 3 -0.292281320694E+03 0.16411E-03 -0.71415E-03 237 0.326E-01 0.282E-01
DAV: 4 -0.292282727633E+03 -0.14069E-02 -0.50353E-03 219 0.277E-01 0.818E-02
DAV: 5 -0.292282711375E+03 0.16257E-04 -0.79236E-04 219 0.113E-01 0.492E-02
DAV: 6 -0.292282730529E+03 -0.19154E-04 -0.40390E-04 219 0.716E-02 0.227E-02
DAV: 7 -0.292282743204E+03 -0.12675E-04 -0.63466E-05 219 0.305E-02 0.104E-02
DAV: 8 -0.292282767328E+03 -0.24124E-04 -0.72575E-06 138 0.117E-02 0.471E-03
DAV: 9 -0.292282790870E+03 -0.23542E-04 -0.35174E-06 156 0.844E-03 0.207E-03
DAV: 10 -0.292282815231E+03 -0.24361E-04 -0.21093E-06 147 0.646E-03 0.141E-03
DAV: 11 -0.292282839068E+03 -0.23836E-04 -0.14689E-06 156 0.489E-03 0.134E-03
DAV: 12 -0.292282855675E+03 -0.16608E-04 -0.96284E-07 147 0.374E-03 0.763E-04
DAV: 13 -0.292282870031E+03 -0.14356E-04 -0.86626E-07 147 0.314E-03 0.511E-04
DAV: 14 -0.292282879203E+03 -0.91720E-05 -0.55470E-07 147 0.219E-03
28 F= -.29228288E+03 E0= -.29228682E+03 d E =-.361613E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292293189416E+03 -0.10319E-01 -0.27938E+00 186 0.586E+00 0.357E-01
DAV: 2 -0.292297926024E+03 -0.47366E-02 -0.63515E-02 225 0.766E-01 0.212E-01
DAV: 3 -0.292297915336E+03 0.10688E-04 -0.17686E-03 225 0.166E-01 0.125E-01
DAV: 4 -0.292298146577E+03 -0.23124E-03 -0.88104E-04 207 0.140E-01 0.304E-02
DAV: 5 -0.292298176144E+03 -0.29567E-04 -0.22952E-04 219 0.539E-02 0.232E-02
DAV: 6 -0.292298174682E+03 0.14612E-05 -0.41948E-05 210 0.245E-02
29 F= -.29229817E+03 E0= -.29230210E+03 d E =-.152955E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292298105118E+03 0.71025E-04 -0.30137E+00 186 0.609E+00 0.373E-01
DAV: 2 -0.292303222524E+03 -0.51174E-02 -0.68733E-02 228 0.796E-01 0.221E-01
DAV: 3 -0.292303218128E+03 0.43965E-05 -0.18955E-03 237 0.173E-01 0.130E-01
DAV: 4 -0.292303460816E+03 -0.24269E-03 -0.94590E-04 219 0.147E-01 0.312E-02
DAV: 5 -0.292303495655E+03 -0.34839E-04 -0.25224E-04 219 0.565E-02 0.242E-02
DAV: 6 -0.292303498570E+03 -0.29155E-05 -0.43874E-05 210 0.250E-02
30 F= -.29230350E+03 E0= -.29230741E+03 d E =-.206194E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292309372170E+03 -0.58765E-02 -0.17320E+00 186 0.450E+00 0.297E-01
DAV: 2 -0.292312302024E+03 -0.29299E-02 -0.40811E-02 216 0.602E-01 0.168E-01
DAV: 3 -0.292312311948E+03 -0.99241E-05 -0.13265E-03 237 0.131E-01 0.976E-02
DAV: 4 -0.292312403076E+03 -0.91129E-04 -0.49187E-04 210 0.102E-01 0.254E-02
DAV: 5 -0.292312422026E+03 -0.18949E-04 -0.12869E-04 228 0.404E-02 0.162E-02
DAV: 6 -0.292312425674E+03 -0.36480E-05 -0.20585E-05 192 0.176E-02
31 F= -.29231243E+03 E0= -.29231634E+03 d E =-.892710E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292312697939E+03 -0.27591E-03 -0.23060E-01 192 0.165E+00 0.109E-01
DAV: 2 -0.292313096257E+03 -0.39832E-03 -0.54996E-03 219 0.222E-01 0.617E-02
DAV: 3 -0.292313092382E+03 0.38753E-05 -0.17692E-04 237 0.485E-02 0.361E-02
DAV: 4 -0.292313105141E+03 -0.12759E-04 -0.67572E-05 228 0.387E-02 0.965E-03
DAV: 5 -0.292313112303E+03 -0.71624E-05 -0.17511E-05 174 0.158E-02
32 F= -.29231311E+03 E0= -.29231703E+03 d E =-.961373E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292317303747E+03 -0.41986E-02 -0.14702E+00 186 0.414E+00 0.275E-01
DAV: 2 -0.292319671974E+03 -0.23682E-02 -0.34419E-02 216 0.555E-01 0.157E-01
DAV: 3 -0.292319715688E+03 -0.43714E-04 -0.12037E-03 228 0.131E-01 0.900E-02
DAV: 4 -0.292319876250E+03 -0.16056E-03 -0.46411E-04 207 0.888E-02 0.269E-02
DAV: 5 -0.292319887254E+03 -0.11003E-04 -0.94983E-05 219 0.378E-02 0.145E-02
DAV: 6 -0.292319888845E+03 -0.15914E-05 -0.18242E-05 150 0.160E-02
33 F= -.29231989E+03 E0= -.29232382E+03 d E =-.677654E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292320028748E+03 -0.14149E-03 -0.84959E-02 192 0.994E-01 0.670E-02
DAV: 2 -0.292320168356E+03 -0.13961E-03 -0.20015E-03 213 0.134E-01 0.375E-02
DAV: 3 -0.292320169833E+03 -0.14770E-05 -0.69900E-05 228 0.319E-02
34 F= -.29232017E+03 E0= -.29232410E+03 d E =-.705753E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292323612152E+03 -0.34438E-02 -0.65836E-01 186 0.289E+00 0.184E-01
DAV: 2 -0.292324634281E+03 -0.10221E-02 -0.14446E-02 216 0.383E-01 0.108E-01
DAV: 3 -0.292324614747E+03 0.19535E-04 -0.50962E-04 237 0.911E-02 0.620E-02
DAV: 4 -0.292324699734E+03 -0.84988E-04 -0.22728E-04 213 0.560E-02 0.195E-02
DAV: 5 -0.292324710969E+03 -0.11234E-04 -0.36401E-05 201 0.227E-02 0.975E-03
DAV: 6 -0.292324714515E+03 -0.35460E-05 -0.46027E-06 147 0.765E-03
35 F= -.29232471E+03 E0= -.29232866E+03 d E =-.454468E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292325065363E+03 -0.35439E-03 -0.14461E-01 189 0.136E+00 0.859E-02
DAV: 2 -0.292325301157E+03 -0.23579E-03 -0.32367E-03 216 0.181E-01 0.501E-02
DAV: 3 -0.292325295997E+03 0.51599E-05 -0.11008E-04 237 0.427E-02 0.290E-02
DAV: 4 -0.292325316396E+03 -0.20399E-04 -0.51379E-05 201 0.269E-02 0.925E-03
DAV: 5 -0.292325320400E+03 -0.40040E-05 -0.76819E-06 147 0.112E-02
36 F= -.29232532E+03 E0= -.29232928E+03 d E =-.515057E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292326694679E+03 -0.13783E-02 -0.20853E-01 192 0.165E+00 0.109E-01
DAV: 2 -0.292327066504E+03 -0.37183E-03 -0.54349E-03 204 0.237E-01 0.706E-02
DAV: 3 -0.292327043304E+03 0.23201E-04 -0.21960E-04 225 0.553E-02 0.409E-02
DAV: 4 -0.292327050101E+03 -0.67970E-05 -0.73117E-05 204 0.340E-02
37 F= -.29232705E+03 E0= -.29233102E+03 d E =-.172970E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292327062964E+03 -0.19660E-04 -0.18855E-03 219 0.157E-01 0.132E-02
DAV: 2 -0.292327066393E+03 -0.34289E-05 -0.52081E-05 219 0.234E-02
38 F= -.29232707E+03 E0= -.29233104E+03 d E =-.174599E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292328425917E+03 -0.13630E-02 -0.19221E-01 192 0.159E+00 0.102E-01
DAV: 2 -0.292328743709E+03 -0.31779E-03 -0.44374E-03 207 0.216E-01 0.660E-02
DAV: 3 -0.292328726451E+03 0.17258E-04 -0.17959E-04 219 0.534E-02 0.363E-02
DAV: 4 -0.292328748803E+03 -0.22351E-04 -0.67043E-05 204 0.328E-02 0.107E-02
DAV: 5 -0.292328752651E+03 -0.38482E-05 -0.10408E-05 147 0.126E-02
39 F= -.29232875E+03 E0= -.29233273E+03 d E =-.168626E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292328912056E+03 -0.16325E-03 -0.62464E-02 186 0.904E-01 0.576E-02
DAV: 2 -0.292329019149E+03 -0.10709E-03 -0.14628E-03 216 0.124E-01 0.369E-02
DAV: 3 -0.292329012006E+03 0.71428E-05 -0.55408E-05 219 0.299E-02
40 F= -.29232901E+03 E0= -.29233299E+03 d E =-.194561E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292330218457E+03 -0.11993E-02 -0.19637E-01 186 0.160E+00 0.101E-01
DAV: 2 -0.292330521749E+03 -0.30329E-03 -0.43360E-03 213 0.213E-01 0.672E-02
DAV: 3 -0.292330503950E+03 0.17798E-04 -0.15986E-04 225 0.501E-02 0.373E-02
DAV: 4 -0.292330526627E+03 -0.22677E-04 -0.69935E-05 195 0.344E-02 0.937E-03
DAV: 5 -0.292330529835E+03 -0.32081E-05 -0.14337E-05 165 0.144E-02
41 F= -.29233053E+03 E0= -.29233451E+03 d E =-.151783E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292330668364E+03 -0.14174E-03 -0.69770E-02 186 0.953E-01 0.590E-02
DAV: 2 -0.292330781752E+03 -0.11339E-03 -0.15849E-03 204 0.129E-01 0.393E-02
DAV: 3 -0.292330772911E+03 0.88414E-05 -0.54625E-05 219 0.295E-02
42 F= -.29233077E+03 E0= -.29233476E+03 d E =-.176090E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292331996984E+03 -0.12152E-02 -0.14331E-01 186 0.134E+00 0.871E-02
DAV: 2 -0.292332184747E+03 -0.18776E-03 -0.28849E-03 213 0.172E-01 0.557E-02
DAV: 3 -0.292332183292E+03 0.14552E-05 -0.98599E-05 237 0.388E-02
43 F= -.29233218E+03 E0= -.29233618E+03 d E =-.141038E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292332567463E+03 -0.38272E-03 -0.37585E-01 186 0.217E+00 0.141E-01
DAV: 2 -0.292333063268E+03 -0.49580E-03 -0.75296E-03 216 0.277E-01 0.896E-02
DAV: 3 -0.292333051488E+03 0.11780E-04 -0.25480E-04 228 0.624E-02 0.462E-02
DAV: 4 -0.292333108250E+03 -0.56762E-04 -0.98711E-05 213 0.380E-02 0.107E-02
DAV: 5 -0.292333112179E+03 -0.39292E-05 -0.15346E-05 156 0.152E-02
44 F= -.29233311E+03 E0= -.29233713E+03 d E =-.233927E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292334253712E+03 -0.11455E-02 -0.21980E-01 186 0.166E+00 0.102E-01
DAV: 2 -0.292334564600E+03 -0.31089E-03 -0.46166E-03 204 0.218E-01 0.656E-02
DAV: 3 -0.292334554645E+03 0.99550E-05 -0.15359E-04 243 0.463E-02 0.355E-02
DAV: 4 -0.292334591512E+03 -0.36868E-04 -0.54796E-05 189 0.284E-02 0.834E-03
DAV: 5 -0.292334595605E+03 -0.40926E-05 -0.81962E-06 147 0.110E-02
45 F= -.29233460E+03 E0= -.29233863E+03 d E =-.148343E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292334741589E+03 -0.15008E-03 -0.35400E-01 186 0.211E+00 0.129E-01
DAV: 2 -0.292335240553E+03 -0.49896E-03 -0.74278E-03 195 0.276E-01 0.834E-02
DAV: 3 -0.292335220604E+03 0.19950E-04 -0.24732E-04 246 0.588E-02 0.452E-02
DAV: 4 -0.292335273918E+03 -0.53315E-04 -0.90087E-05 204 0.364E-02 0.107E-02
DAV: 5 -0.292335279269E+03 -0.53509E-05 -0.13579E-05 156 0.142E-02
46 F= -.29233528E+03 E0= -.29233934E+03 d E =-.216709E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292336158981E+03 -0.88506E-03 -0.34140E-01 186 0.207E+00 0.127E-01
DAV: 2 -0.292336677061E+03 -0.51808E-03 -0.74992E-03 213 0.274E-01 0.860E-02
DAV: 3 -0.292336639990E+03 0.37071E-04 -0.20496E-04 228 0.576E-02 0.466E-02
DAV: 4 -0.292336689494E+03 -0.49504E-04 -0.10326E-04 198 0.389E-02 0.104E-02
DAV: 5 -0.292336695412E+03 -0.59185E-05 -0.16693E-05 183 0.155E-02
47 F= -.29233670E+03 E0= -.29234078E+03 d E =-.141614E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292336742296E+03 -0.52802E-04 -0.65257E-02 192 0.907E-01 0.556E-02
DAV: 2 -0.292336840258E+03 -0.97962E-04 -0.14482E-03 234 0.120E-01 0.374E-02
DAV: 3 -0.292336834898E+03 0.53597E-05 -0.37424E-05 183 0.249E-02
48 F= -.29233683E+03 E0= -.29234093E+03 d E =-.155563E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292337839047E+03 -0.99879E-03 -0.34328E-01 186 0.205E+00 0.126E-01
DAV: 2 -0.292338326268E+03 -0.48722E-03 -0.72669E-03 225 0.268E-01 0.840E-02
DAV: 3 -0.292338310180E+03 0.16088E-04 -0.22218E-04 225 0.569E-02 0.437E-02
DAV: 4 -0.292338376677E+03 -0.66497E-04 -0.86954E-05 213 0.352E-02 0.105E-02
DAV: 5 -0.292338382920E+03 -0.62432E-05 -0.12730E-05 165 0.135E-02
49 F= -.29233838E+03 E0= -.29234249E+03 d E =-.154802E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292338573326E+03 -0.19665E-03 -0.13625E-01 186 0.129E+00 0.786E-02
DAV: 2 -0.292338769410E+03 -0.19608E-03 -0.29501E-03 225 0.170E-01 0.525E-02
DAV: 3 -0.292338762107E+03 0.73028E-05 -0.84636E-05 225 0.353E-02
50 F= -.29233876E+03 E0= -.29234288E+03 d E =-.192721E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292340023729E+03 -0.12543E-02 -0.31895E-01 186 0.196E+00 0.123E-01
DAV: 2 -0.292340427622E+03 -0.40389E-03 -0.65769E-03 216 0.255E-01 0.822E-02
DAV: 3 -0.292340412334E+03 0.15288E-04 -0.21219E-04 234 0.561E-02 0.438E-02
DAV: 4 -0.292340484215E+03 -0.71881E-04 -0.10625E-04 213 0.391E-02 0.115E-02
DAV: 5 -0.292340489111E+03 -0.48956E-05 -0.16231E-05 183 0.160E-02
51 F= -.29234049E+03 E0= -.29234459E+03 d E =-.172700E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292340794341E+03 -0.31013E-03 -0.15691E-01 186 0.137E+00 0.847E-02
DAV: 2 -0.292341012257E+03 -0.21792E-03 -0.33446E-03 225 0.181E-01 0.571E-02
DAV: 3 -0.292341001043E+03 0.11215E-04 -0.10008E-04 237 0.389E-02 0.312E-02
DAV: 4 -0.292341036669E+03 -0.35626E-04 -0.55539E-05 195 0.283E-02 0.823E-03
DAV: 5 -0.292341039739E+03 -0.30698E-05 -0.83030E-06 147 0.118E-02
52 F= -.29234104E+03 E0= -.29234513E+03 d E =-.227763E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292342168997E+03 -0.11323E-02 -0.40213E-01 186 0.221E+00 0.132E-01
DAV: 2 -0.292342746768E+03 -0.57777E-03 -0.86945E-03 207 0.291E-01 0.885E-02
DAV: 3 -0.292342714797E+03 0.31971E-04 -0.24288E-04 225 0.605E-02 0.493E-02
DAV: 4 -0.292342792574E+03 -0.77778E-04 -0.15632E-04 198 0.479E-02 0.132E-02
DAV: 5 -0.292342795747E+03 -0.31723E-05 -0.28062E-05 201 0.198E-02
53 F= -.29234280E+03 E0= -.29234687E+03 d E =-.175601E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292342513361E+03 0.27921E-03 -0.74924E-01 186 0.301E+00 0.180E-01
DAV: 2 -0.292343608205E+03 -0.10948E-02 -0.16286E-02 204 0.398E-01 0.121E-01
DAV: 3 -0.292343544047E+03 0.64158E-04 -0.45189E-04 228 0.828E-02 0.676E-02
DAV: 4 -0.292343670634E+03 -0.12659E-03 -0.29538E-04 207 0.657E-02 0.182E-02
DAV: 5 -0.292343675004E+03 -0.43700E-05 -0.54683E-05 219 0.276E-02
54 F= -.29234368E+03 E0= -.29234773E+03 d E =-.263527E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292344269338E+03 -0.59870E-03 -0.19203E-01 186 0.150E+00 0.911E-02
DAV: 2 -0.292344573579E+03 -0.30424E-03 -0.42519E-03 207 0.197E-01 0.588E-02
DAV: 3 -0.292344568231E+03 0.53487E-05 -0.10091E-04 228 0.375E-02 0.324E-02
DAV: 4 -0.292344604038E+03 -0.35808E-04 -0.58879E-05 204 0.298E-02 0.786E-03
DAV: 5 -0.292344607595E+03 -0.35569E-05 -0.11122E-05 165 0.122E-02
55 F= -.29234461E+03 E0= -.29234866E+03 d E =-.932591E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292343312069E+03 0.12920E-02 -0.17261E+00 189 0.449E+00 0.272E-01
DAV: 2 -0.292345951094E+03 -0.26390E-02 -0.37719E-02 216 0.590E-01 0.177E-01
DAV: 3 -0.292345864577E+03 0.86517E-04 -0.93553E-04 219 0.113E-01 0.964E-02
DAV: 4 -0.292346108841E+03 -0.24426E-03 -0.49401E-04 204 0.868E-02 0.221E-02
DAV: 5 -0.292346123607E+03 -0.14765E-04 -0.98342E-05 219 0.345E-02 0.144E-02
DAV: 6 -0.292346129241E+03 -0.56345E-05 -0.25283E-05 183 0.164E-02
56 F= -.29234613E+03 E0= -.29235016E+03 d E =-.245424E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292345851577E+03 0.27203E-03 -0.23170E-01 192 0.165E+00 0.100E-01
DAV: 2 -0.292346212888E+03 -0.36131E-03 -0.50459E-03 207 0.216E-01 0.648E-02
DAV: 3 -0.292346203017E+03 0.98705E-05 -0.12496E-04 228 0.413E-02 0.349E-02
DAV: 4 -0.292346235813E+03 -0.32796E-04 -0.62431E-05 195 0.309E-02 0.786E-03
DAV: 5 -0.292346240926E+03 -0.51125E-05 -0.11692E-05 165 0.122E-02
57 F= -.29234624E+03 E0= -.29235027E+03 d E =-.256592E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292346854595E+03 -0.61878E-03 -0.63051E-01 186 0.273E+00 0.162E-01
DAV: 2 -0.292347907009E+03 -0.10524E-02 -0.14127E-02 204 0.364E-01 0.107E-01
DAV: 3 -0.292347864656E+03 0.42353E-04 -0.34639E-04 246 0.690E-02 0.593E-02
DAV: 4 -0.292347937209E+03 -0.72553E-04 -0.17702E-04 204 0.521E-02 0.128E-02
DAV: 5 -0.292347945062E+03 -0.78529E-05 -0.36214E-05 210 0.215E-02
58 F= -.29234795E+03 E0= -.29235196E+03 d E =-.170414E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292347593967E+03 0.34324E-03 -0.47532E-01 186 0.237E+00 0.141E-01
DAV: 2 -0.292348394570E+03 -0.80060E-03 -0.10707E-02 207 0.317E-01 0.930E-02
DAV: 3 -0.292348361399E+03 0.33171E-04 -0.26000E-04 237 0.598E-02 0.515E-02
DAV: 4 -0.292348412046E+03 -0.50647E-04 -0.13442E-04 204 0.455E-02 0.113E-02
DAV: 5 -0.292348418659E+03 -0.66129E-05 -0.27244E-05 201 0.190E-02
59 F= -.29234842E+03 E0= -.29235242E+03 d E =-.217773E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292349136294E+03 -0.72425E-03 -0.36782E-01 186 0.209E+00 0.124E-01
DAV: 2 -0.292349769814E+03 -0.63352E-03 -0.83199E-03 216 0.280E-01 0.826E-02
DAV: 3 -0.292349741147E+03 0.28668E-04 -0.19653E-04 243 0.555E-02 0.468E-02
DAV: 4 -0.292349785370E+03 -0.44223E-04 -0.11883E-04 204 0.440E-02 0.109E-02
DAV: 5 -0.292349791234E+03 -0.58643E-05 -0.23704E-05 183 0.178E-02
60 F= -.29234979E+03 E0= -.29235378E+03 d E =-.137258E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292349643485E+03 0.14188E-03 -0.33377E-01 186 0.199E+00 0.118E-01
DAV: 2 -0.292350215922E+03 -0.57244E-03 -0.75461E-03 216 0.267E-01 0.788E-02
DAV: 3 -0.292350186973E+03 0.28949E-04 -0.17716E-04 234 0.529E-02 0.446E-02
DAV: 4 -0.292350223314E+03 -0.36341E-04 -0.10947E-04 207 0.423E-02 0.104E-02
DAV: 5 -0.292350228034E+03 -0.47202E-05 -0.22112E-05 183 0.172E-02
61 F= -.29235023E+03 E0= -.29235420E+03 d E =-.180938E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292350886023E+03 -0.66271E-03 -0.41593E-01 186 0.222E+00 0.129E-01
DAV: 2 -0.292351572278E+03 -0.68625E-03 -0.91017E-03 204 0.289E-01 0.871E-02
DAV: 3 -0.292351541898E+03 0.30380E-04 -0.21582E-04 228 0.586E-02 0.487E-02
DAV: 4 -0.292351592140E+03 -0.50242E-04 -0.12574E-04 219 0.436E-02 0.110E-02
DAV: 5 -0.292351597567E+03 -0.54265E-05 -0.23556E-05 201 0.176E-02
62 F= -.29235160E+03 E0= -.29235559E+03 d E =-.136953E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292351058287E+03 0.53385E-03 -0.70783E-01 186 0.290E+00 0.168E-01
DAV: 2 -0.292352218509E+03 -0.11602E-02 -0.15475E-02 204 0.377E-01 0.114E-01
DAV: 3 -0.292352165134E+03 0.53374E-04 -0.36688E-04 228 0.762E-02 0.635E-02
DAV: 4 -0.292352247868E+03 -0.82734E-04 -0.21400E-04 219 0.568E-02 0.143E-02
DAV: 5 -0.292352255500E+03 -0.76316E-05 -0.40276E-05 210 0.230E-02
63 F= -.29235226E+03 E0= -.29235627E+03 d E =-.202747E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292352228122E+03 0.19747E-04 -0.56568E-01 186 0.260E+00 0.155E-01
DAV: 2 -0.292353192734E+03 -0.96461E-03 -0.12997E-02 204 0.348E-01 0.105E-01
DAV: 3 -0.292353134559E+03 0.58175E-04 -0.32463E-04 228 0.700E-02 0.598E-02
DAV: 4 -0.292353193090E+03 -0.58531E-04 -0.17971E-04 213 0.526E-02 0.131E-02
DAV: 5 -0.292353200088E+03 -0.69979E-05 -0.34494E-05 201 0.217E-02
64 F= -.29235320E+03 E0= -.29235723E+03 d E =-.944588E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292353203769E+03 -0.10679E-04 -0.60022E-06 147 0.909E-03 0.369E-03
DAV: 2 -0.292353206405E+03 -0.26360E-05 -0.84181E-07 147 0.366E-03
65 F= -.29235321E+03 E0= -.29235723E+03 d E =-.950905E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292353667958E+03 -0.46419E-03 -0.40156E-01 186 0.216E+00 0.125E-01
DAV: 2 -0.292354279900E+03 -0.61194E-03 -0.85169E-03 207 0.277E-01 0.867E-02
DAV: 3 -0.292354246915E+03 0.32986E-04 -0.21399E-04 234 0.556E-02 0.487E-02
DAV: 4 -0.292354295877E+03 -0.48963E-04 -0.11645E-04 213 0.422E-02 0.111E-02
DAV: 5 -0.292354301222E+03 -0.53443E-05 -0.21947E-05 201 0.172E-02
66 F= -.29235430E+03 E0= -.29235832E+03 d E =-.109482E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292354146608E+03 0.14927E-03 -0.28092E-01 186 0.181E+00 0.105E-01
DAV: 2 -0.292354581906E+03 -0.43530E-03 -0.59828E-03 204 0.232E-01 0.723E-02
DAV: 3 -0.292354558885E+03 0.23020E-04 -0.14744E-04 228 0.465E-02 0.408E-02
DAV: 4 -0.292354593197E+03 -0.34312E-04 -0.82518E-05 213 0.356E-02 0.943E-03
DAV: 5 -0.292354597371E+03 -0.41743E-05 -0.15244E-05 174 0.147E-02
67 F= -.29235460E+03 E0= -.29235861E+03 d E =-.139097E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292355086176E+03 -0.49298E-03 -0.32178E-01 186 0.194E+00 0.111E-01
DAV: 2 -0.292355574953E+03 -0.48878E-03 -0.66897E-03 207 0.248E-01 0.756E-02
DAV: 3 -0.292355554618E+03 0.20335E-04 -0.16199E-04 225 0.486E-02 0.412E-02
DAV: 4 -0.292355594522E+03 -0.39903E-04 -0.80537E-05 213 0.351E-02 0.888E-03
DAV: 5 -0.292355599220E+03 -0.46980E-05 -0.14194E-05 174 0.133E-02
68 F= -.29235560E+03 E0= -.29235960E+03 d E =-.100185E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292355022144E+03 0.57238E-03 -0.73446E-01 186 0.293E+00 0.168E-01
DAV: 2 -0.292356131193E+03 -0.11090E-02 -0.15289E-02 207 0.375E-01 0.114E-01
DAV: 3 -0.292356082697E+03 0.48496E-04 -0.37255E-04 234 0.736E-02 0.624E-02
DAV: 4 -0.292356171754E+03 -0.89057E-04 -0.18465E-04 213 0.532E-02 0.135E-02
DAV: 5 -0.292356180109E+03 -0.83545E-05 -0.33711E-05 201 0.203E-02
69 F= -.29235618E+03 E0= -.29236017E+03 d E =-.158274E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292356434160E+03 -0.26241E-03 -0.49622E-01 186 0.241E+00 0.138E-01
DAV: 2 -0.292357221991E+03 -0.78783E-03 -0.10640E-02 198 0.315E-01 0.941E-02
DAV: 3 -0.292357184954E+03 0.37037E-04 -0.25330E-04 234 0.602E-02 0.529E-02
DAV: 4 -0.292357242087E+03 -0.57133E-04 -0.12426E-04 207 0.457E-02 0.111E-02
DAV: 5 -0.292357250220E+03 -0.81329E-05 -0.26304E-05 201 0.183E-02
70 F= -.29235725E+03 E0= -.29236124E+03 d E =-.107011E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292357007629E+03 0.23446E-03 -0.30976E-01 186 0.191E+00 0.109E-01
DAV: 2 -0.292357499151E+03 -0.49152E-03 -0.66372E-03 198 0.249E-01 0.742E-02
DAV: 3 -0.292357474770E+03 0.24381E-04 -0.15741E-04 237 0.475E-02 0.416E-02
DAV: 4 -0.292357508369E+03 -0.33599E-04 -0.76826E-05 213 0.363E-02 0.877E-03
DAV: 5 -0.292357514296E+03 -0.59270E-05 -0.16355E-05 192 0.147E-02
71 F= -.29235751E+03 E0= -.29236151E+03 d E =-.133419E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292357801067E+03 -0.29270E-03 -0.50493E-01 186 0.242E+00 0.137E-01
DAV: 2 -0.292358612496E+03 -0.81143E-03 -0.10787E-02 198 0.311E-01 0.954E-02
DAV: 3 -0.292358577169E+03 0.35327E-04 -0.23230E-04 225 0.589E-02 0.542E-02
DAV: 4 -0.292358639456E+03 -0.62287E-04 -0.13525E-04 216 0.480E-02 0.110E-02
DAV: 5 -0.292358646275E+03 -0.68190E-05 -0.29554E-05 201 0.192E-02
72 F= -.29235865E+03 E0= -.29236265E+03 d E =-.113198E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292357690684E+03 0.94877E-03 -0.90285E-01 186 0.324E+00 0.184E-01
DAV: 2 -0.292359129667E+03 -0.14390E-02 -0.19320E-02 198 0.417E-01 0.128E-01
DAV: 3 -0.292359061596E+03 0.68071E-04 -0.41574E-04 225 0.787E-02 0.728E-02
DAV: 4 -0.292359174890E+03 -0.11329E-03 -0.24443E-04 216 0.645E-02 0.148E-02
DAV: 5 -0.292359185505E+03 -0.10615E-04 -0.53961E-05 219 0.259E-02 0.943E-03
DAV: 6 -0.292359190341E+03 -0.48362E-05 -0.63692E-06 141 0.964E-03
73 F= -.29235919E+03 E0= -.29236320E+03 d E =-.167605E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292359590280E+03 -0.40478E-03 -0.28979E-01 186 0.183E+00 0.105E-01
DAV: 2 -0.292360056916E+03 -0.46664E-03 -0.62383E-03 198 0.236E-01 0.719E-02
DAV: 3 -0.292360038658E+03 0.18258E-04 -0.12868E-04 234 0.439E-02 0.409E-02
DAV: 4 -0.292360079649E+03 -0.40991E-04 -0.83791E-05 213 0.368E-02 0.883E-03
DAV: 5 -0.292360084272E+03 -0.46229E-05 -0.16848E-05 192 0.152E-02
74 F= -.29236008E+03 E0= -.29236409E+03 d E =-.893931E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292357631807E+03 0.24478E-02 -0.20924E+00 186 0.492E+00 0.283E-01
DAV: 2 -0.292360956005E+03 -0.33242E-02 -0.45222E-02 198 0.635E-01 0.193E-01
DAV: 3 -0.292360801816E+03 0.15419E-03 -0.93956E-04 225 0.119E-01 0.111E-01
DAV: 4 -0.292361117895E+03 -0.31608E-03 -0.61993E-04 213 0.100E-01 0.242E-02
DAV: 5 -0.292361135005E+03 -0.17110E-04 -0.12875E-04 219 0.414E-02 0.146E-02
DAV: 6 -0.292361142453E+03 -0.74475E-05 -0.22622E-05 192 0.162E-02
75 F= -.29236114E+03 E0= -.29236514E+03 d E =-.195211E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292361613541E+03 -0.47854E-03 -0.19890E-01 186 0.154E+00 0.901E-02
DAV: 2 -0.292361943608E+03 -0.33007E-03 -0.44276E-03 195 0.202E-01 0.603E-02
DAV: 3 -0.292361929641E+03 0.13967E-04 -0.10098E-04 237 0.387E-02 0.346E-02
DAV: 4 -0.292361962291E+03 -0.32649E-04 -0.59094E-05 213 0.316E-02 0.759E-03
DAV: 5 -0.292361967553E+03 -0.52621E-05 -0.11450E-05 174 0.128E-02
76 F= -.29236197E+03 E0= -.29236597E+03 d E =-.825100E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292361586590E+03 0.37570E-03 -0.57067E-01 186 0.260E+00 0.151E-01
DAV: 2 -0.292362516594E+03 -0.93000E-03 -0.12689E-02 195 0.343E-01 0.102E-01
DAV: 3 -0.292362463824E+03 0.52769E-04 -0.28717E-04 234 0.660E-02 0.592E-02
DAV: 4 -0.292362551470E+03 -0.87646E-04 -0.18024E-04 198 0.553E-02 0.132E-02
DAV: 5 -0.292362558580E+03 -0.71096E-05 -0.36732E-05 201 0.225E-02
77 F= -.29236256E+03 E0= -.29236656E+03 d E =-.141613E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292362946119E+03 -0.39465E-03 -0.28790E-01 186 0.186E+00 0.108E-01
DAV: 2 -0.292363397489E+03 -0.45137E-03 -0.63061E-03 207 0.245E-01 0.717E-02
DAV: 3 -0.292363373940E+03 0.23549E-04 -0.15520E-04 222 0.485E-02 0.418E-02
DAV: 4 -0.292363417297E+03 -0.43357E-04 -0.89272E-05 207 0.393E-02 0.102E-02
DAV: 5 -0.292363423040E+03 -0.57432E-05 -0.17527E-05 192 0.154E-02
78 F= -.29236342E+03 E0= -.29236741E+03 d E =-.864460E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292363014079E+03 0.40322E-03 -0.50592E-01 186 0.247E+00 0.143E-01
DAV: 2 -0.292363794003E+03 -0.77992E-03 -0.11034E-02 204 0.325E-01 0.952E-02
DAV: 3 -0.292363751163E+03 0.42840E-04 -0.27461E-04 222 0.643E-02 0.555E-02
DAV: 4 -0.292363826338E+03 -0.75175E-04 -0.15542E-04 198 0.518E-02 0.135E-02
DAV: 5 -0.292363834812E+03 -0.84742E-05 -0.31091E-05 210 0.203E-02
79 F= -.29236383E+03 E0= -.29236782E+03 d E =-.127623E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292364090136E+03 -0.26380E-03 -0.35871E-01 186 0.208E+00 0.120E-01
DAV: 2 -0.292364642224E+03 -0.55209E-03 -0.77061E-03 207 0.272E-01 0.795E-02
DAV: 3 -0.292364615513E+03 0.26711E-04 -0.17169E-04 213 0.516E-02 0.459E-02
DAV: 4 -0.292364668273E+03 -0.52760E-04 -0.11759E-04 207 0.452E-02 0.107E-02
DAV: 5 -0.292364673127E+03 -0.48540E-05 -0.25040E-05 210 0.183E-02
80 F= -.29236467E+03 E0= -.29236865E+03 d E =-.838315E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292363932384E+03 0.73589E-03 -0.75646E-01 186 0.302E+00 0.174E-01
DAV: 2 -0.292365070328E+03 -0.11379E-02 -0.16189E-02 207 0.395E-01 0.116E-01
DAV: 3 -0.292365006606E+03 0.63722E-04 -0.36340E-04 216 0.749E-02 0.666E-02
DAV: 4 -0.292365130512E+03 -0.12391E-03 -0.24457E-04 207 0.655E-02 0.154E-02
DAV: 5 -0.292365138792E+03 -0.82791E-05 -0.52928E-05 219 0.264E-02
81 F= -.29236514E+03 E0= -.29236911E+03 d E =-.130398E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292365402300E+03 -0.27179E-03 -0.46383E-01 186 0.237E+00 0.136E-01
DAV: 2 -0.292366093360E+03 -0.69106E-03 -0.97726E-03 207 0.309E-01 0.913E-02
DAV: 3 -0.292366057800E+03 0.35560E-04 -0.23235E-04 222 0.608E-02 0.521E-02
DAV: 4 -0.292366139498E+03 -0.81698E-04 -0.14791E-04 198 0.496E-02 0.127E-02
DAV: 5 -0.292366145450E+03 -0.59521E-05 -0.29335E-05 201 0.203E-02
82 F= -.29236615E+03 E0= -.29237011E+03 d E =-.100666E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292365358641E+03 0.78086E-03 -0.81036E-01 186 0.314E+00 0.179E-01
DAV: 2 -0.292366546554E+03 -0.11879E-02 -0.16997E-02 207 0.407E-01 0.121E-01
DAV: 3 -0.292366478798E+03 0.67756E-04 -0.40522E-04 222 0.800E-02 0.685E-02
DAV: 4 -0.292366630691E+03 -0.15189E-03 -0.25507E-04 207 0.653E-02 0.166E-02
DAV: 5 -0.292366640607E+03 -0.99155E-05 -0.50605E-05 219 0.263E-02
83 F= -.29236664E+03 E0= -.29237061E+03 d E =-.150182E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292366920932E+03 -0.29024E-03 -0.39996E-01 186 0.221E+00 0.126E-01
DAV: 2 -0.292367503345E+03 -0.58241E-03 -0.83342E-03 207 0.287E-01 0.855E-02
DAV: 3 -0.292367478118E+03 0.25227E-04 -0.20486E-04 225 0.577E-02 0.484E-02
DAV: 4 -0.292367560398E+03 -0.82280E-04 -0.13475E-04 207 0.470E-02 0.124E-02
DAV: 5 -0.292367564919E+03 -0.45212E-05 -0.26350E-05 192 0.199E-02
84 F= -.29236756E+03 E0= -.29237153E+03 d E =-.924313E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292367011546E+03 0.54885E-03 -0.63906E-01 186 0.279E+00 0.160E-01
DAV: 2 -0.292367932112E+03 -0.92057E-03 -0.13270E-02 207 0.362E-01 0.108E-01
DAV: 3 -0.292367886281E+03 0.45831E-04 -0.32780E-04 228 0.727E-02 0.612E-02
DAV: 4 -0.292368010151E+03 -0.12387E-03 -0.21428E-04 210 0.589E-02 0.155E-02
DAV: 5 -0.292368016474E+03 -0.63228E-05 -0.42956E-05 219 0.248E-02
85 F= -.29236802E+03 E0= -.29237197E+03 d E =-.137587E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292368273562E+03 -0.26341E-03 -0.55463E-01 186 0.261E+00 0.151E-01
DAV: 2 -0.292369061457E+03 -0.78789E-03 -0.11504E-02 204 0.340E-01 0.100E-01
DAV: 3 -0.292369026664E+03 0.34792E-04 -0.28258E-04 234 0.673E-02 0.570E-02
DAV: 4 -0.292369139077E+03 -0.11241E-03 -0.18998E-04 195 0.546E-02 0.146E-02
DAV: 5 -0.292369145399E+03 -0.63220E-05 -0.36915E-05 219 0.230E-02
86 F= -.29236915E+03 E0= -.29237310E+03 d E =-.112893E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292366508105E+03 0.26310E-02 -0.23151E+00 186 0.533E+00 0.310E-01
DAV: 2 -0.292369916520E+03 -0.34084E-02 -0.48053E-02 207 0.695E-01 0.205E-01
DAV: 3 -0.292369745460E+03 0.17106E-03 -0.11869E-03 225 0.137E-01 0.117E-01
DAV: 4 -0.292370103762E+03 -0.35830E-03 -0.78667E-04 207 0.111E-01 0.296E-02
DAV: 5 -0.292370128470E+03 -0.24708E-04 -0.15292E-04 228 0.468E-02 0.168E-02
DAV: 6 -0.292370137086E+03 -0.86163E-05 -0.42638E-05 219 0.216E-02
87 F= -.29237014E+03 E0= -.29237409E+03 d E =-.212061E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292370447125E+03 -0.31866E-03 -0.56313E-01 186 0.264E+00 0.153E-01
DAV: 2 -0.292371209654E+03 -0.76253E-03 -0.11509E-02 204 0.340E-01 0.101E-01
DAV: 3 -0.292371190903E+03 0.18751E-04 -0.29415E-04 222 0.672E-02 0.557E-02
DAV: 4 -0.292371313635E+03 -0.12273E-03 -0.16447E-04 207 0.516E-02 0.130E-02
DAV: 5 -0.292371321913E+03 -0.82782E-05 -0.31272E-05 201 0.206E-02
88 F= -.29237132E+03 E0= -.29237527E+03 d E =-.118483E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292367001556E+03 0.43121E-02 -0.37581E+00 186 0.682E+00 0.395E-01
DAV: 2 -0.292372421397E+03 -0.54198E-02 -0.77349E-02 207 0.881E-01 0.260E-01
DAV: 3 -0.292372167366E+03 0.25403E-03 -0.19757E-03 225 0.175E-01 0.146E-01
DAV: 4 -0.292372750012E+03 -0.58265E-03 -0.11666E-03 207 0.138E-01 0.350E-02
DAV: 5 -0.292372781682E+03 -0.31671E-04 -0.22920E-04 219 0.556E-02 0.215E-02
DAV: 6 -0.292372790698E+03 -0.90153E-05 -0.66617E-05 213 0.270E-02
89 F= -.29237279E+03 E0= -.29237673E+03 d E =-.265361E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292373022795E+03 -0.24111E-03 -0.68855E-01 186 0.292E+00 0.171E-01
DAV: 2 -0.292373986394E+03 -0.96360E-03 -0.14356E-02 198 0.379E-01 0.111E-01
DAV: 3 -0.292373966573E+03 0.19822E-04 -0.37758E-04 231 0.747E-02 0.617E-02
DAV: 4 -0.292374089583E+03 -0.12301E-03 -0.19179E-04 198 0.563E-02 0.142E-02
DAV: 5 -0.292374100317E+03 -0.10734E-04 -0.38164E-05 228 0.221E-02 0.916E-03
DAV: 6 -0.292374106474E+03 -0.61564E-05 -0.11039E-05 168 0.113E-02
90 F= -.29237411E+03 E0= -.29237803E+03 d E =-.131578E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292370665825E+03 0.34345E-02 -0.30088E+00 186 0.610E+00 0.356E-01
DAV: 2 -0.292374964092E+03 -0.42983E-02 -0.62738E-02 207 0.794E-01 0.232E-01
DAV: 3 -0.292374788300E+03 0.17579E-03 -0.16618E-03 225 0.157E-01 0.130E-01
DAV: 4 -0.292375237869E+03 -0.44957E-03 -0.86418E-04 207 0.119E-01 0.301E-02
DAV: 5 -0.292375269520E+03 -0.31651E-04 -0.17182E-04 219 0.470E-02 0.192E-02
DAV: 6 -0.292375278170E+03 -0.86503E-05 -0.53764E-05 213 0.241E-02
91 F= -.29237528E+03 E0= -.29237919E+03 d E =-.248747E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292375607072E+03 -0.33755E-03 -0.49331E-01 186 0.247E+00 0.143E-01
DAV: 2 -0.292376297661E+03 -0.69059E-03 -0.10181E-02 207 0.318E-01 0.941E-02
DAV: 3 -0.292376284333E+03 0.13328E-04 -0.25199E-04 225 0.612E-02 0.523E-02
DAV: 4 -0.292376369985E+03 -0.85652E-04 -0.14046E-04 207 0.486E-02 0.118E-02
DAV: 5 -0.292376377927E+03 -0.79426E-05 -0.28727E-05 201 0.193E-02
92 F= -.29237638E+03 E0= -.29238029E+03 d E =-.109976E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292371678056E+03 0.46919E-02 -0.44399E+00 186 0.740E+00 0.428E-01
DAV: 2 -0.292378069419E+03 -0.63914E-02 -0.91628E-02 216 0.954E-01 0.282E-01
DAV: 3 -0.292377781403E+03 0.28802E-03 -0.22809E-03 225 0.185E-01 0.158E-01
DAV: 4 -0.292378380070E+03 -0.59867E-03 -0.13141E-03 207 0.149E-01 0.364E-02
DAV: 5 -0.292378418663E+03 -0.38593E-04 -0.27161E-04 219 0.595E-02 0.232E-02
DAV: 6 -0.292378429891E+03 -0.11228E-04 -0.89942E-05 213 0.312E-02 0.129E-02
DAV: 7 -0.292378432990E+03 -0.30987E-05 -0.10472E-05 174 0.130E-02
93 F= -.29237843E+03 E0= -.29238234E+03 d E =-.315482E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292349893413E+03 0.28536E-01 -0.17752E+01 186 0.148E+01 0.862E-01
DAV: 2 -0.292376309540E+03 -0.26416E-01 -0.36829E-01 216 0.191E+00 0.565E-01
DAV: 3 -0.292374879477E+03 0.14301E-02 -0.93779E-03 228 0.373E-01 0.320E-01
DAV: 4 -0.292376766093E+03 -0.18866E-02 -0.49720E-03 216 0.291E-01 0.720E-02
DAV: 5 -0.292376946364E+03 -0.18027E-03 -0.10364E-03 228 0.116E-01 0.447E-02
DAV: 6 -0.292376979393E+03 -0.33029E-04 -0.30897E-04 219 0.588E-02 0.246E-02
DAV: 7 -0.292376987303E+03 -0.79101E-05 -0.42453E-05 219 0.250E-02
94 F= -.29237699E+03 E0= -.29238088E+03 d E =-.170913E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292365942367E+03 0.11037E-01 -0.83727E+00 186 0.102E+01 0.591E-01
DAV: 2 -0.292378238548E+03 -0.12296E-01 -0.17466E-01 210 0.132E+00 0.389E-01
DAV: 3 -0.292377611716E+03 0.62683E-03 -0.44091E-03 237 0.256E-01 0.220E-01
DAV: 4 -0.292378764309E+03 -0.11526E-02 -0.27221E-03 216 0.214E-01 0.533E-02
DAV: 5 -0.292378820631E+03 -0.56322E-04 -0.57699E-04 228 0.858E-02 0.341E-02
DAV: 6 -0.292378830393E+03 -0.97622E-05 -0.19125E-04 207 0.455E-02 0.183E-02
DAV: 7 -0.292378829247E+03 0.11461E-05 -0.25506E-05 201 0.194E-02
95 F= -.29237883E+03 E0= -.29238273E+03 d E =-.355108E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292378874665E+03 -0.44272E-04 -0.99896E-01 186 0.350E+00 0.202E-01
DAV: 2 -0.292380277578E+03 -0.14029E-02 -0.20462E-02 195 0.450E-01 0.136E-01
DAV: 3 -0.292380228224E+03 0.49354E-04 -0.49623E-04 234 0.892E-02 0.761E-02
DAV: 4 -0.292380376455E+03 -0.14823E-03 -0.33458E-04 216 0.727E-02 0.187E-02
DAV: 5 -0.292380380225E+03 -0.37702E-05 -0.66441E-05 219 0.303E-02
96 F= -.29238038E+03 E0= -.29238428E+03 d E =-.155098E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292369094790E+03 0.11282E-01 -0.89992E+00 186 0.105E+01 0.612E-01
DAV: 2 -0.292382296278E+03 -0.13201E-01 -0.18633E-01 216 0.136E+00 0.407E-01
DAV: 3 -0.292381644100E+03 0.65218E-03 -0.45041E-03 225 0.268E-01 0.229E-01
DAV: 4 -0.292382767698E+03 -0.11236E-02 -0.29139E-03 210 0.216E-01 0.546E-02
DAV: 5 -0.292382814748E+03 -0.47050E-04 -0.58054E-04 219 0.894E-02 0.333E-02
DAV: 6 -0.292382830912E+03 -0.16163E-04 -0.16987E-04 219 0.431E-02 0.178E-02
DAV: 7 -0.292382834322E+03 -0.34108E-05 -0.22982E-05 201 0.190E-02
97 F= -.29238283E+03 E0= -.29238672E+03 d E =-.400508E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292381716182E+03 0.11147E-02 -0.83076E-01 186 0.320E+00 0.186E-01
DAV: 2 -0.292382897201E+03 -0.11810E-02 -0.17174E-02 207 0.412E-01 0.123E-01
DAV: 3 -0.292382855515E+03 0.41685E-04 -0.42060E-04 219 0.811E-02 0.688E-02
DAV: 4 -0.292382969282E+03 -0.11377E-03 -0.26550E-04 210 0.655E-02 0.164E-02
DAV: 5 -0.292382978703E+03 -0.94206E-05 -0.52988E-05 219 0.268E-02
98 F= -.29238298E+03 E0= -.29238686E+03 d E =-.414946E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292381032168E+03 0.19371E-02 -0.27937E+00 186 0.585E+00 0.339E-01
DAV: 2 -0.292385125657E+03 -0.40935E-02 -0.57615E-02 207 0.753E-01 0.227E-01
DAV: 3 -0.292384953921E+03 0.17174E-03 -0.13776E-03 225 0.147E-01 0.126E-01
DAV: 4 -0.292385306769E+03 -0.35285E-03 -0.89226E-04 210 0.120E-01 0.304E-02
DAV: 5 -0.292385318723E+03 -0.11954E-04 -0.17789E-04 219 0.503E-02 0.181E-02
DAV: 6 -0.292385329177E+03 -0.10454E-04 -0.52724E-05 219 0.243E-02 0.984E-03
DAV: 7 -0.292385333212E+03 -0.40353E-05 -0.60125E-06 165 0.109E-02
99 F= -.29238533E+03 E0= -.29238922E+03 d E =-.235451E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292377694079E+03 0.76351E-02 -0.58548E+00 186 0.846E+00 0.491E-01
DAV: 2 -0.292386162948E+03 -0.84689E-02 -0.11973E-01 216 0.109E+00 0.328E-01
DAV: 3 -0.292385766181E+03 0.39677E-03 -0.29184E-03 225 0.213E-01 0.181E-01
DAV: 4 -0.292386454495E+03 -0.68831E-03 -0.18076E-03 219 0.170E-01 0.428E-02
DAV: 5 -0.292386480497E+03 -0.26002E-04 -0.35284E-04 219 0.708E-02 0.256E-02
DAV: 6 -0.292386498414E+03 -0.17917E-04 -0.10524E-04 219 0.344E-02 0.141E-02
DAV: 7 -0.292386504364E+03 -0.59498E-05 -0.12629E-05 183 0.156E-02
100 F= -.29238650E+03 E0= -.29239038E+03 d E =-.352566E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292382732192E+03 0.37662E-02 -0.43853E+00 186 0.731E+00 0.425E-01
DAV: 2 -0.292388939368E+03 -0.62072E-02 -0.87458E-02 207 0.932E-01 0.283E-01
DAV: 3 -0.292388670858E+03 0.26851E-03 -0.21935E-03 234 0.186E-01 0.155E-01
DAV: 4 -0.292389173946E+03 -0.50309E-03 -0.12501E-03 207 0.141E-01 0.344E-02
DAV: 5 -0.292389202849E+03 -0.28903E-04 -0.23985E-04 228 0.587E-02 0.205E-02
DAV: 6 -0.292389217086E+03 -0.14237E-04 -0.50592E-05 210 0.238E-02 0.108E-02
DAV: 7 -0.292389224595E+03 -0.75092E-05 -0.60005E-06 174 0.105E-02
101 F= -.29238922E+03 E0= -.29239310E+03 d E =-.272023E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292385232144E+03 0.39849E-02 -0.31628E+00 186 0.621E+00 0.361E-01
DAV: 2 -0.292389694032E+03 -0.44619E-02 -0.63164E-02 207 0.792E-01 0.240E-01
DAV: 3 -0.292389506867E+03 0.18716E-03 -0.15856E-03 225 0.158E-01 0.131E-01
DAV: 4 -0.292389878870E+03 -0.37200E-03 -0.90559E-04 207 0.120E-01 0.292E-02
DAV: 5 -0.292389900345E+03 -0.21475E-04 -0.17322E-04 228 0.502E-02 0.176E-02
DAV: 6 -0.292389912205E+03 -0.11860E-04 -0.38391E-05 204 0.207E-02 0.929E-03
DAV: 7 -0.292389918618E+03 -0.64123E-05 -0.43396E-06 156 0.907E-03
102 F= -.29238992E+03 E0= -.29239380E+03 d E =-.341425E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292388114441E+03 0.17978E-02 -0.25794E+00 186 0.560E+00 0.329E-01
DAV: 2 -0.292391701699E+03 -0.35873E-02 -0.51575E-02 207 0.717E-01 0.218E-01
DAV: 3 -0.292391541416E+03 0.16028E-03 -0.14436E-03 225 0.144E-01 0.116E-01
DAV: 4 -0.292391855876E+03 -0.31446E-03 -0.65553E-04 216 0.102E-01 0.263E-02
DAV: 5 -0.292391878201E+03 -0.22325E-04 -0.12217E-04 219 0.416E-02 0.148E-02
DAV: 6 -0.292391886991E+03 -0.87900E-05 -0.21897E-05 195 0.162E-02
103 F= -.29239189E+03 E0= -.29239577E+03 d E =-.196837E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292391506383E+03 0.37182E-03 -0.36921E-01 186 0.212E+00 0.125E-01
DAV: 2 -0.292392026998E+03 -0.52062E-03 -0.73666E-03 207 0.271E-01 0.824E-02
DAV: 3 -0.292392009515E+03 0.17483E-04 -0.20326E-04 219 0.544E-02 0.433E-02
DAV: 4 -0.292392056621E+03 -0.47106E-04 -0.91692E-05 213 0.382E-02 0.977E-03
DAV: 5 -0.292392063059E+03 -0.64378E-05 -0.16405E-05 183 0.155E-02
104 F= -.29239206E+03 E0= -.29239594E+03 d E =-.214444E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292391925619E+03 0.13100E-03 -0.11886E+00 186 0.380E+00 0.228E-01
DAV: 2 -0.292393529732E+03 -0.16041E-02 -0.24025E-02 198 0.491E-01 0.151E-01
DAV: 3 -0.292393446564E+03 0.83168E-04 -0.69937E-04 234 0.102E-01 0.808E-02
DAV: 4 -0.292393621052E+03 -0.17449E-03 -0.34821E-04 225 0.716E-02 0.191E-02
DAV: 5 -0.292393630125E+03 -0.90730E-05 -0.63852E-05 219 0.302E-02
105 F= -.29239363E+03 E0= -.29239751E+03 d E =-.156707E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292393460380E+03 0.16067E-03 -0.34878E-01 186 0.206E+00 0.124E-01
DAV: 2 -0.292393939146E+03 -0.47877E-03 -0.70940E-03 207 0.266E-01 0.815E-02
DAV: 3 -0.292393920511E+03 0.18635E-04 -0.20150E-04 237 0.552E-02 0.439E-02
DAV: 4 -0.292393976815E+03 -0.56304E-04 -0.10360E-04 228 0.391E-02 0.106E-02
DAV: 5 -0.292393981312E+03 -0.44964E-05 -0.18671E-05 192 0.169E-02
106 F= -.29239398E+03 E0= -.29239786E+03 d E =-.191825E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292394619492E+03 -0.64268E-03 -0.60179E-01 186 0.272E+00 0.162E-01
DAV: 2 -0.292395397875E+03 -0.77838E-03 -0.11901E-02 207 0.348E-01 0.110E-01
DAV: 3 -0.292395345264E+03 0.52611E-04 -0.37860E-04 234 0.756E-02 0.595E-02
DAV: 4 -0.292395432744E+03 -0.87480E-04 -0.19470E-04 207 0.538E-02 0.146E-02
DAV: 5 -0.292395438003E+03 -0.52591E-05 -0.36976E-05 219 0.224E-02
107 F= -.29239544E+03 E0= -.29239931E+03 d E =-.145669E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292395222965E+03 0.20978E-03 -0.43548E-01 186 0.232E+00 0.138E-01
DAV: 2 -0.292395787529E+03 -0.56456E-03 -0.86417E-03 219 0.297E-01 0.932E-02
DAV: 3 -0.292395750940E+03 0.36588E-04 -0.27285E-04 234 0.645E-02 0.508E-02
DAV: 4 -0.292395817971E+03 -0.67031E-04 -0.14266E-04 210 0.461E-02 0.126E-02
DAV: 5 -0.292395822160E+03 -0.41890E-05 -0.26107E-05 183 0.193E-02
108 F= -.29239582E+03 E0= -.29239970E+03 d E =-.184085E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292396294001E+03 -0.47603E-03 -0.24192E-01 186 0.172E+00 0.105E-01
DAV: 2 -0.292396601388E+03 -0.30739E-03 -0.47425E-03 210 0.221E-01 0.682E-02
DAV: 3 -0.292396586337E+03 0.15052E-04 -0.14461E-04 219 0.476E-02 0.362E-02
DAV: 4 -0.292396625789E+03 -0.39452E-04 -0.76365E-05 201 0.330E-02 0.908E-03
DAV: 5 -0.292396628305E+03 -0.25162E-05 -0.12972E-05 174 0.143E-02
109 F= -.29239663E+03 E0= -.29240050E+03 d E =-.806145E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292396023297E+03 0.60249E-03 -0.94583E-01 186 0.341E+00 0.207E-01
DAV: 2 -0.292397209403E+03 -0.11861E-02 -0.18472E-02 207 0.436E-01 0.135E-01
DAV: 3 -0.292397138696E+03 0.70708E-04 -0.56940E-04 225 0.939E-02 0.713E-02
DAV: 4 -0.292397275325E+03 -0.13663E-03 -0.29304E-04 210 0.647E-02 0.174E-02
DAV: 5 -0.292397280740E+03 -0.54149E-05 -0.52622E-05 219 0.275E-02
110 F= -.29239728E+03 E0= -.29240116E+03 d E =-.145858E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292397897511E+03 -0.62219E-03 -0.13040E-01 192 0.126E+00 0.774E-02
DAV: 2 -0.292398059871E+03 -0.16236E-03 -0.24673E-03 210 0.161E-01 0.512E-02
DAV: 3 -0.292398053513E+03 0.63581E-05 -0.87977E-05 237 0.371E-02
111 F= -.29239805E+03 E0= -.29240193E+03 d E =-.772773E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292398087904E+03 -0.28033E-04 -0.49664E-01 192 0.246E+00 0.154E-01
DAV: 2 -0.292398648543E+03 -0.56064E-03 -0.90542E-03 192 0.310E-01 0.101E-01
DAV: 3 -0.292398624200E+03 0.24344E-04 -0.34694E-04 246 0.724E-02 0.495E-02
DAV: 4 -0.292398687960E+03 -0.63760E-04 -0.13719E-04 219 0.427E-02 0.128E-02
DAV: 5 -0.292398692240E+03 -0.42801E-05 -0.17593E-05 165 0.170E-02
112 F= -.29239869E+03 E0= -.29240257E+03 d E =-.141150E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292399336177E+03 -0.64822E-03 -0.13211E-01 192 0.126E+00 0.779E-02
DAV: 2 -0.292399493115E+03 -0.15694E-03 -0.24441E-03 210 0.161E-01 0.517E-02
DAV: 3 -0.292399486406E+03 0.67089E-05 -0.83643E-05 219 0.368E-02
113 F= -.29239949E+03 E0= -.29240336E+03 d E =-.794166E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292399524266E+03 -0.31151E-04 -0.11804E+00 186 0.378E+00 0.236E-01
DAV: 2 -0.292400834963E+03 -0.13107E-02 -0.21322E-02 207 0.476E-01 0.155E-01
DAV: 3 -0.292400765812E+03 0.69151E-04 -0.76349E-04 228 0.109E-01 0.752E-02
DAV: 4 -0.292400899242E+03 -0.13343E-03 -0.35217E-04 195 0.681E-02 0.204E-02
DAV: 5 -0.292400903625E+03 -0.43829E-05 -0.50171E-05 219 0.283E-02
114 F= -.29240090E+03 E0= -.29240478E+03 d E =-.221138E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292400781504E+03 0.11774E-03 -0.22109E-01 192 0.164E+00 0.101E-01
DAV: 2 -0.292401047552E+03 -0.26605E-03 -0.41129E-03 219 0.208E-01 0.670E-02
DAV: 3 -0.292401035971E+03 0.11581E-04 -0.13898E-04 228 0.477E-02 0.333E-02
DAV: 4 -0.292401066899E+03 -0.30927E-04 -0.70168E-05 210 0.308E-02 0.924E-03
DAV: 5 -0.292401070090E+03 -0.31911E-05 -0.10065E-05 156 0.134E-02
115 F= -.29240107E+03 E0= -.29240494E+03 d E =-.237785E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292401885762E+03 -0.81886E-03 -0.33117E-01 192 0.201E+00 0.124E-01
DAV: 2 -0.292402289903E+03 -0.40414E-03 -0.63116E-03 219 0.257E-01 0.835E-02
DAV: 3 -0.292402265179E+03 0.24724E-04 -0.21942E-04 219 0.594E-02 0.416E-02
DAV: 4 -0.292402306333E+03 -0.41154E-04 -0.11887E-04 210 0.396E-02 0.117E-02
DAV: 5 -0.292402307832E+03 -0.14996E-05 -0.18205E-05 174 0.170E-02
116 F= -.29240231E+03 E0= -.29240618E+03 d E =-.123774E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292402662539E+03 -0.35621E-03 -0.27875E-01 192 0.184E+00 0.114E-01
DAV: 2 -0.292403003740E+03 -0.34120E-03 -0.53317E-03 210 0.236E-01 0.767E-02
DAV: 3 -0.292402982974E+03 0.20767E-04 -0.18434E-04 210 0.546E-02 0.384E-02
DAV: 4 -0.292403016780E+03 -0.33806E-04 -0.10171E-04 219 0.367E-02 0.109E-02
DAV: 5 -0.292403017841E+03 -0.10614E-05 -0.15931E-05 174 0.160E-02
117 F= -.29240302E+03 E0= -.29240689E+03 d E =-.194775E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292401848361E+03 0.11684E-02 -0.11135E+00 186 0.368E+00 0.227E-01
DAV: 2 -0.292403188112E+03 -0.13398E-02 -0.21207E-02 216 0.471E-01 0.153E-01
DAV: 3 -0.292403093451E+03 0.94661E-04 -0.73737E-04 219 0.109E-01 0.762E-02
DAV: 4 -0.292403220709E+03 -0.12726E-03 -0.39678E-04 210 0.725E-02 0.212E-02
DAV: 5 -0.292403221466E+03 -0.75692E-06 -0.64642E-05 219 0.310E-02
118 F= -.29240322E+03 E0= -.29240710E+03 d E =-.215138E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292403131758E+03 0.88951E-04 -0.17898E-01 192 0.147E+00 0.913E-02
DAV: 2 -0.292403334710E+03 -0.20295E-03 -0.33395E-03 228 0.188E-01 0.613E-02
DAV: 3 -0.292403324011E+03 0.10699E-04 -0.12405E-04 228 0.436E-02 0.298E-02
DAV: 4 -0.292403349077E+03 -0.25066E-04 -0.59824E-05 219 0.279E-02 0.785E-03
DAV: 5 -0.292403351527E+03 -0.24508E-05 -0.75831E-06 147 0.112E-02
119 F= -.29240335E+03 E0= -.29240723E+03 d E =-.228144E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292404114948E+03 -0.76587E-03 -0.50835E-01 192 0.249E+00 0.154E-01
DAV: 2 -0.292404709678E+03 -0.59473E-03 -0.96781E-03 207 0.318E-01 0.101E-01
DAV: 3 -0.292404676264E+03 0.33414E-04 -0.32475E-04 216 0.695E-02 0.483E-02
DAV: 4 -0.292404728211E+03 -0.51947E-04 -0.15126E-04 198 0.446E-02 0.122E-02
DAV: 5 -0.292404728985E+03 -0.77367E-06 -0.21981E-05 183 0.182E-02
120 F= -.29240473E+03 E0= -.29240860E+03 d E =-.137746E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292404424074E+03 0.30414E-03 -0.84549E-01 186 0.321E+00 0.198E-01
DAV: 2 -0.292405441195E+03 -0.10171E-02 -0.16204E-02 216 0.411E-01 0.130E-01
DAV: 3 -0.292405385009E+03 0.56186E-04 -0.52951E-04 216 0.896E-02 0.629E-02
DAV: 4 -0.292405474684E+03 -0.89675E-04 -0.25886E-04 219 0.585E-02 0.162E-02
DAV: 5 -0.292405476187E+03 -0.15036E-05 -0.40968E-05 210 0.248E-02
121 F= -.29240548E+03 E0= -.29240935E+03 d E =-.212466E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292406158213E+03 -0.68353E-03 -0.70531E-01 186 0.293E+00 0.180E-01
DAV: 2 -0.292407006900E+03 -0.84869E-03 -0.13465E-02 201 0.374E-01 0.118E-01
DAV: 3 -0.292406968233E+03 0.38667E-04 -0.47729E-04 228 0.835E-02 0.572E-02
DAV: 4 -0.292407046917E+03 -0.78684E-04 -0.18441E-04 210 0.499E-02 0.142E-02
DAV: 5 -0.292407053609E+03 -0.66921E-05 -0.26027E-05 183 0.192E-02
122 F= -.29240705E+03 E0= -.29241093E+03 d E =-.157742E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292407142414E+03 -0.95497E-04 -0.18548E-01 192 0.150E+00 0.920E-02
DAV: 2 -0.292407368822E+03 -0.22641E-03 -0.35533E-03 210 0.192E-01 0.604E-02
DAV: 3 -0.292407360671E+03 0.81507E-05 -0.12418E-04 228 0.427E-02 0.293E-02
DAV: 4 -0.292407383659E+03 -0.22988E-04 -0.48781E-05 201 0.258E-02 0.731E-03
DAV: 5 -0.292407387312E+03 -0.36524E-05 -0.67419E-06 147 0.101E-02
123 F= -.29240739E+03 E0= -.29241126E+03 d E =-.191112E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292407384299E+03 -0.64003E-06 -0.38523E-02 192 0.685E-01 0.418E-02
DAV: 2 -0.292407432422E+03 -0.48122E-04 -0.73813E-04 219 0.874E-02 0.275E-02
DAV: 3 -0.292407431683E+03 0.73813E-06 -0.24823E-05 192 0.195E-02
124 F= -.29240743E+03 E0= -.29241130E+03 d E =-.195550E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292407982544E+03 -0.55012E-03 -0.74505E-01 186 0.299E+00 0.186E-01
DAV: 2 -0.292408817631E+03 -0.83509E-03 -0.13802E-02 207 0.379E-01 0.122E-01
DAV: 3 -0.292408783914E+03 0.33718E-04 -0.49595E-04 216 0.856E-02 0.581E-02
DAV: 4 -0.292408872703E+03 -0.88789E-04 -0.20109E-04 219 0.524E-02 0.141E-02
DAV: 5 -0.292408877349E+03 -0.46462E-05 -0.29268E-05 183 0.207E-02
125 F= -.29240888E+03 E0= -.29241275E+03 d E =-.144567E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292408107134E+03 0.76557E-03 -0.12282E+00 186 0.384E+00 0.238E-01
DAV: 2 -0.292409543726E+03 -0.14366E-02 -0.23062E-02 207 0.489E-01 0.156E-01
DAV: 3 -0.292409469111E+03 0.74615E-04 -0.79882E-04 213 0.109E-01 0.754E-02
DAV: 4 -0.292409608091E+03 -0.13898E-03 -0.34203E-04 216 0.684E-02 0.183E-02
DAV: 5 -0.292409615552E+03 -0.74615E-05 -0.52648E-05 210 0.275E-02
126 F= -.29240962E+03 E0= -.29241349E+03 d E =-.218387E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292410234478E+03 -0.62639E-03 -0.70290E-01 186 0.290E+00 0.180E-01
DAV: 2 -0.292411075479E+03 -0.84100E-03 -0.13352E-02 207 0.373E-01 0.118E-01
DAV: 3 -0.292411033600E+03 0.41878E-04 -0.45492E-04 216 0.835E-02 0.563E-02
DAV: 4 -0.292411121559E+03 -0.87959E-04 -0.21075E-04 198 0.530E-02 0.153E-02
DAV: 5 -0.292411125070E+03 -0.35112E-05 -0.31533E-05 201 0.222E-02
127 F= -.29241113E+03 E0= -.29241500E+03 d E =-.150952E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292411134373E+03 -0.12814E-04 -0.56757E-01 186 0.261E+00 0.162E-01
DAV: 2 -0.292411813945E+03 -0.67957E-03 -0.10766E-02 207 0.335E-01 0.106E-01
DAV: 3 -0.292411776897E+03 0.37048E-04 -0.36618E-04 216 0.750E-02 0.504E-02
DAV: 4 -0.292411846397E+03 -0.69499E-04 -0.17032E-04 207 0.475E-02 0.137E-02
DAV: 5 -0.292411849553E+03 -0.31566E-05 -0.24493E-05 174 0.199E-02
128 F= -.29241185E+03 E0= -.29241572E+03 d E =-.223400E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.292408679334E+03 0.31671E-02 -0.22682E+00 186 0.522E+00 0.324E-01
DAV: 2 -0.292411389821E+03 -0.27105E-02 -0.42912E-02 207 0.669E-01 0.212E-01
DAV: 3 -0.292411215297E+03 0.17452E-03 -0.14710E-03 216 0.150E-01 0.101E-01