N E dE d eps ncg rms rms(c)
DAV: 1 0.840605028605E+03 0.84061E+03 -0.70793E+04 58044 0.110E+03
DAV: 2 -0.266270638916E+03 -0.11069E+04 -0.10667E+04 73932 0.280E+02
DAV: 3 -0.361937213256E+03 -0.95667E+02 -0.94430E+02 67119 0.870E+01
DAV: 4 -0.364599963192E+03 -0.26627E+01 -0.26490E+01 73446 0.152E+01
DAV: 5 -0.364683388366E+03 -0.83425E-01 -0.83328E-01 73167 0.261E+00 0.299E+01
DAV: 6 -0.344220500327E+03 0.20463E+02 -0.48039E+01 67353 0.211E+01 0.175E+01
DAV: 7 -0.340672147218E+03 0.35484E+01 -0.17630E+01 72492 0.143E+01 0.103E+01
DAV: 8 -0.339233379217E+03 0.14388E+01 -0.53213E+00 69981 0.745E+00 0.430E+00
DAV: 9 -0.339227035062E+03 0.63442E-02 -0.13185E+00 72222 0.370E+00 0.257E+00
DAV: 10 -0.339180046410E+03 0.46989E-01 -0.42087E-01 76029 0.185E+00 0.114E+00
DAV: 11 -0.339183107393E+03 -0.30610E-02 -0.12558E-01 72006 0.104E+00 0.586E-01
DAV: 12 -0.339184838212E+03 -0.17308E-02 -0.39649E-02 70188 0.562E-01 0.271E-01
DAV: 13 -0.339187290517E+03 -0.24523E-02 -0.85438E-03 69810 0.289E-01 0.157E-01
DAV: 14 -0.339189392855E+03 -0.21023E-02 -0.28612E-03 63951 0.171E-01 0.895E-02
DAV: 15 -0.339190197893E+03 -0.80504E-03 -0.15705E-03 62187 0.125E-01 0.500E-02
DAV: 16 -0.339190181429E+03 0.16465E-04 -0.27909E-04 66363 0.571E-02 0.302E-02
DAV: 17 -0.339190127815E+03 0.53613E-04 -0.10926E-04 63645 0.383E-02 0.128E-02
DAV: 18 -0.339190112933E+03 0.14882E-04 -0.22313E-05 48282 0.167E-02 0.648E-03
DAV: 19 -0.339190110419E+03 0.25137E-05 -0.52276E-06 44952 0.849E-03
1 F= -.33919011E+03 E0= -.33917748E+03 d E =-.339190E+03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.291976781129E+03 0.47213E+02 -0.46377E+03 58458 0.219E+02 0.423E+01
DAV: 2 -0.327334569324E+03 -0.35358E+02 -0.37525E+02 68982 0.569E+01 0.181E+01
DAV: 3 -0.324428054225E+03 0.29065E+01 -0.95722E+00 70971 0.118E+01 0.117E+01
DAV: 4 -0.323132343478E+03 0.12957E+01 -0.44703E+00 70593 0.762E+00 0.387E+00
DAV: 5 -0.323085738953E+03 0.46605E-01 -0.54751E-01 74184 0.273E+00 0.159E+00
DAV: 6 -0.323079014034E+03 0.67249E-02 -0.71695E-02 70692 0.898E-01 0.640E-01
DAV: 7 -0.323076809479E+03 0.22046E-02 -0.13659E-02 66165 0.431E-01 0.205E-01
DAV: 8 -0.323076478042E+03 0.33144E-03 -0.22231E-03 71664 0.194E-01 0.847E-02
DAV: 9 -0.323076467462E+03 0.10580E-04 -0.94440E-04 68352 0.126E-01 0.423E-02
DAV: 10 -0.323076412780E+03 0.54682E-04 -0.25812E-04 69801 0.719E-02 0.259E-02
DAV: 11 -0.323076398178E+03 0.14602E-04 -0.80605E-05 64995 0.324E-02 0.181E-02
DAV: 12 -0.323076389954E+03 0.82243E-05 -0.12360E-05 46743 0.166E-02
2 F= -.32307639E+03 E0= -.32308283E+03 d E =0.161137E+02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.328944028267E+03 -0.58676E+01 -0.33423E+03 58926 0.191E+02 0.245E+01
DAV: 2 -0.348020978401E+03 -0.19077E+02 -0.26134E+02 74202 0.453E+01 0.176E+01
DAV: 3 -0.343876878104E+03 0.41441E+01 -0.14523E+01 73932 0.132E+01 0.103E+01
DAV: 4 -0.343225763805E+03 0.65111E+00 -0.59961E+00 67704 0.783E+00 0.576E+00
DAV: 5 -0.343085019547E+03 0.14074E+00 -0.98024E-01 71880 0.333E+00 0.353E+00
DAV: 6 -0.343037126501E+03 0.47893E-01 -0.49094E-01 67092 0.232E+00 0.130E+00
DAV: 7 -0.343014876241E+03 0.22250E-01 -0.11426E-01 71412 0.124E+00 0.508E-01
DAV: 8 -0.343016260933E+03 -0.13847E-02 -0.36269E-02 64149 0.601E-01 0.325E-01
DAV: 9 -0.343016216562E+03 0.44371E-04 -0.42578E-03 68676 0.204E-01 0.171E-01
DAV: 10 -0.343016106262E+03 0.11030E-03 -0.15714E-03 64059 0.137E-01 0.625E-02
DAV: 11 -0.343016085173E+03 0.21089E-04 -0.29909E-04 68523 0.595E-02 0.403E-02
DAV: 12 -0.343016069960E+03 0.15214E-04 -0.74531E-05 63123 0.309E-02 0.203E-02
DAV: 13 -0.343016065518E+03 0.44411E-05 -0.25737E-05 48390 0.192E-02
3 F= -.34301607E+03 E0= -.34301108E+03 d E =-.382596E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.345030966695E+03 -0.20149E+01 -0.64839E+01 57720 0.268E+01 0.207E+00
DAV: 2 -0.345211465051E+03 -0.18050E+00 -0.21285E+00 72807 0.408E+00 0.112E+00
DAV: 3 -0.345196620307E+03 0.14845E-01 -0.49360E-02 68649 0.791E-01 0.684E-01
DAV: 4 -0.345192488860E+03 0.41314E-02 -0.19292E-02 68172 0.499E-01 0.257E-01
DAV: 5 -0.345192651359E+03 -0.16250E-03 -0.55663E-03 66687 0.238E-01 0.102E-01
DAV: 6 -0.345192642843E+03 0.85163E-05 -0.86816E-04 68262 0.913E-02 0.553E-02
DAV: 7 -0.345192619598E+03 0.23246E-04 -0.12826E-04 67902 0.391E-02 0.327E-02
DAV: 8 -0.345192616326E+03 0.32718E-05 -0.50849E-05 61620 0.245E-02
4 F= -.34519262E+03 E0= -.34519390E+03 d E =-.600251E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.344726097069E+03 0.46652E+00 -0.62246E+02 57720 0.836E+01 0.765E+00
DAV: 2 -0.346654956334E+03 -0.19289E+01 -0.23124E+01 71160 0.135E+01 0.421E+00
DAV: 3 -0.346426051165E+03 0.22891E+00 -0.85277E-01 67065 0.330E+00 0.227E+00
DAV: 4 -0.346354498728E+03 0.71552E-01 -0.15799E-01 70647 0.162E+00 0.936E-01
DAV: 5 -0.346351131483E+03 0.33672E-02 -0.61201E-02 66597 0.801E-01 0.301E-01
DAV: 6 -0.346350877055E+03 0.25443E-03 -0.61784E-03 70368 0.273E-01 0.133E-01
DAV: 7 -0.346350688913E+03 0.18814E-03 -0.94699E-04 71061 0.132E-01 0.573E-02
DAV: 8 -0.346350689860E+03 -0.94691E-06 -0.49229E-04 66039 0.778E-02 0.279E-02
DAV: 9 -0.346350677314E+03 0.12546E-04 -0.72653E-05 67443 0.341E-02 0.129E-02
DAV: 10 -0.346350673389E+03 0.39255E-05 -0.13699E-05 43908 0.156E-02
5 F= -.34635067E+03 E0= -.34635993E+03 d E =-.716056E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.346815526573E+03 -0.46485E+00 -0.15147E+02 57720 0.408E+01 0.390E+00
DAV: 2 -0.347237094062E+03 -0.42157E+00 -0.60552E+00 71889 0.693E+00 0.216E+00
DAV: 3 -0.347169537996E+03 0.67556E-01 -0.17173E-01 70584 0.162E+00 0.129E+00
DAV: 4 -0.347155000005E+03 0.14538E-01 -0.10007E-01 66876 0.105E+00 0.526E-01
DAV: 5 -0.347154030493E+03 0.96951E-03 -0.15561E-02 67515 0.442E-01 0.173E-01
DAV: 6 -0.347153882940E+03 0.14755E-03 -0.17142E-03 68316 0.140E-01 0.866E-02
DAV: 7 -0.347153847529E+03 0.35412E-04 -0.37503E-04 67074 0.667E-02 0.383E-02
DAV: 8 -0.347153838952E+03 0.85762E-05 -0.61555E-05 65661 0.281E-02
6 F= -.34715384E+03 E0= -.34716160E+03 d E =-.796373E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.347243164959E+03 -0.89317E-01 -0.74103E+00 57720 0.910E+00 0.809E-01
DAV: 2 -0.347261742009E+03 -0.18577E-01 -0.24942E-01 72366 0.145E+00 0.433E-01
DAV: 3 -0.347259042950E+03 0.26991E-02 -0.78979E-03 69063 0.331E-01 0.234E-01
DAV: 4 -0.347258522506E+03 0.52044E-03 -0.29208E-03 65139 0.191E-01 0.853E-02
DAV: 5 -0.347258528731E+03 -0.62251E-05 -0.47608E-04 70764 0.730E-02 0.301E-02
DAV: 6 -0.347258524644E+03 0.40875E-05 -0.43065E-05 62862 0.220E-02
7 F= -.34725852E+03 E0= -.34726697E+03 d E =-.806841E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.341588717770E+03 0.56698E+01 -0.18947E+03 57720 0.145E+02 0.183E+01
DAV: 2 -0.349240128962E+03 -0.76514E+01 -0.85281E+01 68181 0.266E+01 0.860E+00
DAV: 3 -0.348628286572E+03 0.61184E+00 -0.26232E+00 69072 0.614E+00 0.553E+00
DAV: 4 -0.348398295222E+03 0.22999E+00 -0.65528E-01 69027 0.290E+00 0.234E+00
DAV: 5 -0.348382306184E+03 0.15989E-01 -0.20463E-01 65184 0.153E+00 0.615E-01
DAV: 6 -0.348382829390E+03 -0.52321E-03 -0.19029E-02 70566 0.502E-01 0.280E-01
DAV: 7 -0.348382787342E+03 0.42048E-04 -0.32675E-03 66849 0.224E-01 0.991E-02
DAV: 8 -0.348382810628E+03 -0.23285E-04 -0.95946E-04 66255 0.116E-01 0.420E-02
DAV: 9 -0.348382802441E+03 0.81863E-05 -0.11310E-04 66948 0.431E-02 0.181E-02
DAV: 10 -0.348382799525E+03 0.29168E-05 -0.35201E-05 57273 0.222E-02
8 F= -.34838280E+03 E0= -.34838724E+03 d E =-.112427E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.349775865188E+03 -0.13931E+01 -0.34112E+02 57720 0.616E+01 0.548E+00
DAV: 2 -0.350718222784E+03 -0.94236E+00 -0.13534E+01 70530 0.108E+01 0.344E+00
DAV: 3 -0.350595044715E+03 0.12318E+00 -0.44716E-01 70278 0.260E+00 0.223E+00
DAV: 4 -0.350570561149E+03 0.24484E-01 -0.24866E-01 65904 0.170E+00 0.102E+00
DAV: 5 -0.350568638232E+03 0.19229E-02 -0.32441E-02 67254 0.707E-01 0.359E-01
DAV: 6 -0.350568981121E+03 -0.34289E-03 -0.58684E-03 67425 0.259E-01 0.127E-01
DAV: 7 -0.350568892665E+03 0.88456E-04 -0.83063E-04 68604 0.124E-01 0.545E-02
DAV: 8 -0.350568898700E+03 -0.60358E-05 -0.19037E-04 64032 0.499E-02 0.239E-02
DAV: 9 -0.350568891109E+03 0.75909E-05 -0.31788E-05 54078 0.228E-02
9 F= -.35056889E+03 E0= -.35057196E+03 d E =-.331037E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.348182507823E+03 0.23864E+01 -0.94610E+02 57720 0.102E+02 0.105E+01
DAV: 2 -0.351238781924E+03 -0.30563E+01 -0.35927E+01 67497 0.184E+01 0.594E+00
DAV: 3 -0.350952151448E+03 0.28663E+00 -0.11298E+00 68793 0.409E+00 0.394E+00
DAV: 4 -0.350854795809E+03 0.97356E-01 -0.43227E-01 67686 0.227E+00 0.190E+00
DAV: 5 -0.350837428471E+03 0.17367E-01 -0.11308E-01 68136 0.120E+00 0.529E-01
DAV: 6 -0.350839208423E+03 -0.17800E-02 -0.20865E-02 67074 0.474E-01 0.265E-01
DAV: 7 -0.350839183344E+03 0.25078E-04 -0.27095E-03 69486 0.201E-01 0.112E-01
DAV: 8 -0.350839218240E+03 -0.34896E-04 -0.62164E-04 68343 0.981E-02 0.377E-02
DAV: 9 -0.350839221635E+03 -0.33944E-05 -0.12336E-04 68568 0.406E-02 0.155E-02
DAV: 10 -0.350839218320E+03 0.33147E-05 -0.17219E-05 45519 0.165E-02
10 F= -.35083922E+03 E0= -.35084309E+03 d E =-.270327E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.351571339665E+03 -0.73212E+00 -0.23875E+02 57720 0.519E+01 0.419E+00
DAV: 2 -0.352212377210E+03 -0.64104E+00 -0.81125E+00 67146 0.860E+00 0.279E+00
DAV: 3 -0.352142700258E+03 0.69677E-01 -0.24212E-01 70890 0.202E+00 0.187E+00
DAV: 4 -0.352121273614E+03 0.21427E-01 -0.13538E-01 65418 0.127E+00 0.779E-01
DAV: 5 -0.352120128481E+03 0.11451E-02 -0.17284E-02 71016 0.524E-01 0.259E-01
DAV: 6 -0.352120400227E+03 -0.27175E-03 -0.30456E-03 65895 0.193E-01 0.112E-01
DAV: 7 -0.352120411232E+03 -0.11004E-04 -0.50810E-04 67479 0.875E-02 0.477E-02
DAV: 8 -0.352120409657E+03 0.15744E-05 -0.95863E-05 65760 0.396E-02
11 F= -.35212041E+03 E0= -.35212401E+03 d E =-.155152E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.352297814625E+03 -0.17740E+00 -0.41309E+02 57741 0.679E+01 0.570E+00
DAV: 2 -0.353232475844E+03 -0.93466E+00 -0.12213E+01 68397 0.105E+01 0.311E+00
DAV: 3 -0.353128632439E+03 0.10384E+00 -0.39150E-01 70053 0.218E+00 0.194E+00
DAV: 4 -0.353096174380E+03 0.32458E-01 -0.11273E-01 68613 0.127E+00 0.676E-01
DAV: 5 -0.353096481507E+03 -0.30713E-03 -0.29336E-02 65238 0.600E-01 0.218E-01
DAV: 6 -0.353096661945E+03 -0.18044E-03 -0.43186E-03 69045 0.216E-01 0.113E-01
DAV: 7 -0.353096564603E+03 0.97342E-04 -0.43084E-04 74139 0.969E-02 0.470E-02
DAV: 8 -0.353096559469E+03 0.51342E-05 -0.16928E-04 65274 0.435E-02 0.174E-02
DAV: 9 -0.353096557309E+03 0.21596E-05 -0.23747E-05 51135 0.189E-02
12 F= -.35309656E+03 E0= -.35310055E+03 d E =-.976148E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.353218256000E+03 -0.12170E+00 -0.31140E+01 58053 0.187E+01 0.132E+00
DAV: 2 -0.353276887856E+03 -0.58632E-01 -0.85328E-01 67803 0.279E+00 0.871E-01
DAV: 3 -0.353268537833E+03 0.83500E-02 -0.27836E-02 70656 0.651E-01 0.525E-01
DAV: 4 -0.353266522405E+03 0.20154E-02 -0.11395E-02 64572 0.383E-01 0.198E-01
DAV: 5 -0.353266613070E+03 -0.90665E-04 -0.20884E-03 70215 0.164E-01 0.704E-02
DAV: 6 -0.353266619477E+03 -0.64071E-05 -0.21446E-04 66183 0.498E-02 0.321E-02
DAV: 7 -0.353266616225E+03 0.32520E-05 -0.34048E-05 50577 0.237E-02
13 F= -.35326662E+03 E0= -.35327050E+03 d E =-.114621E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.352891596141E+03 0.37502E+00 -0.30331E+02 57720 0.579E+01 0.453E+00
DAV: 2 -0.353666242747E+03 -0.77465E+00 -0.97094E+00 66336 0.905E+00 0.285E+00
DAV: 3 -0.353584959891E+03 0.81283E-01 -0.32280E-01 70422 0.197E+00 0.179E+00
DAV: 4 -0.353547956037E+03 0.37004E-01 -0.73475E-02 66813 0.105E+00 0.656E-01
DAV: 5 -0.353546051435E+03 0.19046E-02 -0.30438E-02 68676 0.582E-01 0.180E-01
DAV: 6 -0.353546014203E+03 0.37232E-04 -0.37904E-03 65922 0.208E-01 0.101E-01
DAV: 7 -0.353545926770E+03 0.87434E-04 -0.49561E-04 66660 0.817E-02 0.403E-02
DAV: 8 -0.353545899973E+03 0.26797E-04 -0.15134E-04 68973 0.468E-02 0.168E-02
DAV: 9 -0.353545889351E+03 0.10622E-04 -0.20199E-05 46311 0.171E-02 0.781E-03
DAV: 10 -0.353545883473E+03 0.58783E-05 -0.10672E-05 43044 0.112E-02
14 F= -.35354588E+03 E0= -.35355024E+03 d E =-.279267E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.353788335704E+03 -0.24245E+00 -0.52880E+01 57720 0.242E+01 0.169E+00
DAV: 2 -0.353899916903E+03 -0.11158E+00 -0.15444E+00 66903 0.369E+00 0.114E+00
DAV: 3 -0.353885365496E+03 0.14551E-01 -0.49440E-02 70701 0.781E-01 0.659E-01
DAV: 4 -0.353881040244E+03 0.43253E-02 -0.13963E-02 64752 0.448E-01 0.214E-01
DAV: 5 -0.353881119130E+03 -0.78886E-04 -0.32080E-03 69900 0.188E-01 0.742E-02
DAV: 6 -0.353881092040E+03 0.27090E-04 -0.33365E-04 68136 0.644E-02 0.405E-02
DAV: 7 -0.353881070969E+03 0.21072E-04 -0.61654E-05 67533 0.342E-02 0.146E-02
DAV: 8 -0.353881067823E+03 0.31457E-05 -0.18560E-05 44277 0.149E-02
15 F= -.35388107E+03 E0= -.35388526E+03 d E =-.614452E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.354057084288E+03 -0.17601E+00 -0.15021E+02 57720 0.404E+01 0.280E+00
DAV: 2 -0.354370914573E+03 -0.31383E+00 -0.40340E+00 66948 0.590E+00 0.187E+00
DAV: 3 -0.354337693263E+03 0.33221E-01 -0.12382E-01 70845 0.131E+00 0.116E+00
DAV: 4 -0.354327867392E+03 0.98259E-02 -0.31524E-02 66534 0.671E-01 0.435E-01
DAV: 5 -0.354327931310E+03 -0.63918E-04 -0.93381E-03 67146 0.324E-01 0.117E-01
DAV: 6 -0.354327954523E+03 -0.23214E-04 -0.12479E-03 66867 0.122E-01 0.635E-02
DAV: 7 -0.354327948433E+03 0.60897E-05 -0.12931E-04 69135 0.482E-02 0.253E-02
DAV: 8 -0.354327944906E+03 0.35277E-05 -0.43270E-05 61035 0.229E-02
16 F= -.35432794E+03 E0= -.35433230E+03 d E =-.446877E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.354341942614E+03 -0.13994E-01 -0.51069E+00 57720 0.746E+00 0.465E-01
DAV: 2 -0.354350951545E+03 -0.90089E-02 -0.11860E-01 67074 0.102E+00 0.325E-01
DAV: 3 -0.354349814597E+03 0.11369E-02 -0.37491E-03 70800 0.229E-01 0.182E-01
DAV: 4 -0.354349566785E+03 0.24781E-03 -0.11896E-03 67596 0.128E-01 0.600E-02
DAV: 5 -0.354349585033E+03 -0.18248E-04 -0.24286E-04 67191 0.525E-02 0.213E-02
DAV: 6 -0.354349585842E+03 -0.80942E-06 -0.28791E-05 54267 0.189E-02
17 F= -.35434959E+03 E0= -.35435390E+03 d E =-.468518E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.354639615480E+03 -0.29003E+00 -0.10705E+02 57720 0.338E+01 0.225E+00
DAV: 2 -0.354863557647E+03 -0.22394E+00 -0.27784E+00 67605 0.480E+00 0.151E+00
DAV: 3 -0.354841375509E+03 0.22182E-01 -0.65120E-02 70782 0.975E-01 0.919E-01
DAV: 4 -0.354834581495E+03 0.67940E-02 -0.26490E-02 67524 0.604E-01 0.274E-01
DAV: 5 -0.354835067908E+03 -0.48641E-03 -0.61675E-03 67416 0.259E-01 0.999E-02
DAV: 6 -0.354835040715E+03 0.27193E-04 -0.37317E-04 68685 0.713E-02 0.496E-02
DAV: 7 -0.354835029321E+03 0.11394E-04 -0.10846E-04 64923 0.374E-02 0.137E-02
DAV: 8 -0.354835025869E+03 0.34515E-05 -0.13313E-05 45006 0.175E-02
18 F= -.35483503E+03 E0= -.35483942E+03 d E =-.485440E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.354843452236E+03 -0.84229E-02 -0.51734E+00 57720 0.738E+00 0.456E-01
DAV: 2 -0.354852756732E+03 -0.93045E-02 -0.11834E-01 67659 0.993E-01 0.319E-01
DAV: 3 -0.354851726621E+03 0.10301E-02 -0.28102E-03 70908 0.206E-01 0.182E-01
DAV: 4 -0.354851467558E+03 0.25906E-03 -0.13018E-03 68424 0.134E-01 0.461E-02
DAV: 5 -0.354851491365E+03 -0.23807E-04 -0.26473E-04 66354 0.549E-02 0.218E-02
DAV: 6 -0.354851489513E+03 0.18516E-05 -0.14339E-05 41235 0.147E-02
19 F= -.35485149E+03 E0= -.35485589E+03 d E =-.501904E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.354949971393E+03 -0.98480E-01 -0.11279E+02 57720 0.347E+01 0.236E+00
DAV: 2 -0.355212501793E+03 -0.26253E+00 -0.31357E+00 66750 0.504E+00 0.163E+00
DAV: 3 -0.355186651027E+03 0.25851E-01 -0.72768E-02 69630 0.104E+00 0.103E+00
DAV: 4 -0.355177452031E+03 0.91990E-02 -0.35424E-02 66426 0.707E-01 0.319E-01
DAV: 5 -0.355177870245E+03 -0.41821E-03 -0.83035E-03 66849 0.295E-01 0.110E-01
DAV: 6 -0.355177829230E+03 0.41015E-04 -0.62797E-04 70296 0.868E-02 0.575E-02
DAV: 7 -0.355177807132E+03 0.22097E-04 -0.16441E-04 68712 0.534E-02 0.201E-02
DAV: 8 -0.355177804943E+03 0.21897E-05 -0.27024E-05 49506 0.199E-02
20 F= -.35517780E+03 E0= -.35518231E+03 d E =-.326315E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.355179947098E+03 -0.21400E-02 -0.10950E+00 57798 0.343E+00 0.218E-01
DAV: 2 -0.355182073736E+03 -0.21266E-02 -0.26322E-02 66930 0.473E-01 0.154E-01
DAV: 3 -0.355181835655E+03 0.23808E-03 -0.64020E-04 70152 0.968E-02 0.880E-02
DAV: 4 -0.355181784079E+03 0.51576E-04 -0.28225E-04 67038 0.640E-02 0.253E-02
DAV: 5 -0.355181789337E+03 -0.52581E-05 -0.60237E-05 66741 0.250E-02
21 F= -.35518179E+03 E0= -.35518629E+03 d E =-.330300E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.355343030405E+03 -0.16125E+00 -0.70419E+01 57720 0.275E+01 0.179E+00
DAV: 2 -0.355478938396E+03 -0.13591E+00 -0.17477E+00 66363 0.390E+00 0.124E+00
DAV: 3 -0.355464309761E+03 0.14629E-01 -0.45035E-02 70656 0.791E-01 0.745E-01
DAV: 4 -0.355459645137E+03 0.46646E-02 -0.19976E-02 65517 0.537E-01 0.202E-01
DAV: 5 -0.355460016430E+03 -0.37129E-03 -0.44916E-03 70017 0.232E-01 0.865E-02
DAV: 6 -0.355460006466E+03 0.99643E-05 -0.43143E-04 66570 0.745E-02 0.469E-02
DAV: 7 -0.355459995489E+03 0.10976E-04 -0.72497E-05 65391 0.341E-02 0.163E-02
DAV: 8 -0.355459993424E+03 0.20650E-05 -0.14404E-05 44844 0.158E-02
22 F= -.35545999E+03 E0= -.35546460E+03 d E =-.278204E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.355462007613E+03 -0.20121E-02 -0.14726E+00 57732 0.399E+00 0.249E-01
DAV: 2 -0.355464672157E+03 -0.26645E-02 -0.34525E-02 66471 0.553E-01 0.175E-01
DAV: 3 -0.355464365853E+03 0.30630E-03 -0.88160E-04 70665 0.112E-01 0.100E-01
DAV: 4 -0.355464281097E+03 0.84756E-04 -0.41756E-04 66741 0.774E-02 0.255E-02
DAV: 5 -0.355464288394E+03 -0.72963E-05 -0.90521E-05 68163 0.335E-02
23 F= -.35546429E+03 E0= -.35546891E+03 d E =-.282499E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.355613940504E+03 -0.14966E+00 -0.54717E+01 57720 0.243E+01 0.153E+00
DAV: 2 -0.355721073893E+03 -0.10713E+00 -0.12859E+00 66399 0.329E+00 0.107E+00
DAV: 3 -0.355710518749E+03 0.10555E-01 -0.31847E-02 70665 0.676E-01 0.627E-01
DAV: 4 -0.355707958880E+03 0.25599E-02 -0.12097E-02 66822 0.420E-01 0.187E-01
DAV: 5 -0.355708151109E+03 -0.19223E-03 -0.25080E-03 67947 0.164E-01 0.697E-02
DAV: 6 -0.355708153338E+03 -0.22294E-05 -0.34319E-04 68307 0.644E-02 0.372E-02
DAV: 7 -0.355708135870E+03 0.17469E-04 -0.78715E-05 70224 0.420E-02 0.149E-02
DAV: 8 -0.355708135750E+03 0.11910E-06 -0.18566E-05 42990 0.151E-02
24 F= -.35570814E+03 E0= -.35571280E+03 d E =-.243847E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.355714063777E+03 -0.59279E-02 -0.57926E+00 57720 0.788E+00 0.484E-01
DAV: 2 -0.355724545233E+03 -0.10481E-01 -0.12759E-01 66480 0.104E+00 0.339E-01
DAV: 3 -0.355723455326E+03 0.10899E-02 -0.32593E-03 70608 0.218E-01 0.189E-01
DAV: 4 -0.355723242042E+03 0.21328E-03 -0.12428E-03 68019 0.132E-01 0.546E-02
DAV: 5 -0.355723260283E+03 -0.18240E-04 -0.23231E-04 66300 0.506E-02 0.222E-02
DAV: 6 -0.355723259350E+03 0.93276E-06 -0.31559E-05 58551 0.198E-02
25 F= -.35572326E+03 E0= -.35572793E+03 d E =-.258971E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.355874120665E+03 -0.15086E+00 -0.55003E+01 57720 0.244E+01 0.154E+00
DAV: 2 -0.355975275355E+03 -0.10115E+00 -0.12376E+00 67866 0.326E+00 0.104E+00
DAV: 3 -0.355965034296E+03 0.10241E-01 -0.27286E-02 70602 0.624E-01 0.598E-01
DAV: 4 -0.355962542396E+03 0.24919E-02 -0.12416E-02 66174 0.416E-01 0.147E-01
DAV: 5 -0.355962757365E+03 -0.21497E-03 -0.24744E-03 69009 0.168E-01 0.663E-02
DAV: 6 -0.355962760418E+03 -0.30529E-05 -0.28375E-04 67137 0.572E-02 0.352E-02
DAV: 7 -0.355962749372E+03 0.11045E-04 -0.43860E-05 62034 0.308E-02 0.146E-02
DAV: 8 -0.355962749868E+03 -0.49597E-06 -0.15384E-05 43107 0.133E-02
26 F= -.35596275E+03 E0= -.35596737E+03 d E =-.239491E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.355970582443E+03 -0.78331E-02 -0.94594E+00 57720 0.101E+01 0.619E-01
DAV: 2 -0.355987697035E+03 -0.17115E-01 -0.21158E-01 67668 0.134E+00 0.436E-01
DAV: 3 -0.355985862512E+03 0.18345E-02 -0.46317E-03 70656 0.259E-01 0.242E-01
DAV: 4 -0.355985473653E+03 0.38886E-03 -0.22068E-03 67362 0.175E-01 0.573E-02
DAV: 5 -0.355985508028E+03 -0.34375E-04 -0.43210E-04 67596 0.706E-02 0.275E-02
DAV: 6 -0.355985507889E+03 0.13923E-06 -0.44629E-05 64320 0.226E-02
27 F= -.35598551E+03 E0= -.35599010E+03 d E =-.262249E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.356112950949E+03 -0.12744E+00 -0.49393E+01 57720 0.230E+01 0.148E+00
DAV: 2 -0.356200811667E+03 -0.87861E-01 -0.11000E+00 66714 0.310E+00 0.999E-01
DAV: 3 -0.356191570502E+03 0.92412E-02 -0.29066E-02 70620 0.638E-01 0.558E-01
DAV: 4 -0.356189919106E+03 0.16514E-02 -0.10075E-02 67740 0.391E-01 0.163E-01
DAV: 5 -0.356190108485E+03 -0.18938E-03 -0.20135E-03 66813 0.151E-01 0.643E-02
DAV: 6 -0.356190110471E+03 -0.19863E-05 -0.30242E-04 67344 0.584E-02 0.352E-02
DAV: 7 -0.356190094418E+03 0.16053E-04 -0.46634E-05 65463 0.355E-02 0.152E-02
DAV: 8 -0.356190094804E+03 -0.38585E-06 -0.23458E-05 45150 0.168E-02
28 F= -.35619009E+03 E0= -.35619473E+03 d E =-.204587E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.356195862480E+03 -0.57681E-02 -0.70415E+00 57720 0.873E+00 0.548E-01
DAV: 2 -0.356208373950E+03 -0.12511E-01 -0.15710E-01 66615 0.117E+00 0.378E-01
DAV: 3 -0.356206992136E+03 0.13818E-02 -0.42532E-03 70548 0.248E-01 0.207E-01
DAV: 4 -0.356206755690E+03 0.23645E-03 -0.15474E-03 68568 0.151E-01 0.594E-02
DAV: 5 -0.356206785380E+03 -0.29690E-04 -0.31619E-04 65580 0.594E-02 0.247E-02
DAV: 6 -0.356206784245E+03 0.11347E-05 -0.36515E-05 62925 0.207E-02
29 F= -.35620678E+03 E0= -.35621143E+03 d E =-.221276E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.356312056084E+03 -0.10527E+00 -0.40932E+01 57720 0.212E+01 0.133E+00
DAV: 2 -0.356385590993E+03 -0.73535E-01 -0.91158E-01 66354 0.285E+00 0.934E-01
DAV: 3 -0.356377928601E+03 0.76624E-02 -0.20930E-02 70629 0.560E-01 0.539E-01
DAV: 4 -0.356376168902E+03 0.17597E-02 -0.10568E-02 67947 0.391E-01 0.126E-01
DAV: 5 -0.356376336700E+03 -0.16780E-03 -0.21335E-03 66192 0.158E-01 0.607E-02
DAV: 6 -0.356376335147E+03 0.15530E-05 -0.21983E-04 69000 0.545E-02 0.301E-02
DAV: 7 -0.356376328222E+03 0.69242E-05 -0.36192E-05 61242 0.263E-02
30 F= -.35637633E+03 E0= -.35638099E+03 d E =-.169544E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.356381003729E+03 -0.46686E-02 -0.48684E+00 57720 0.730E+00 0.447E-01
DAV: 2 -0.356389453279E+03 -0.84495E-02 -0.10576E-01 66309 0.974E-01 0.319E-01
DAV: 3 -0.356388532111E+03 0.92117E-03 -0.25268E-03 70710 0.196E-01 0.179E-01
DAV: 4 -0.356388342881E+03 0.18923E-03 -0.12786E-03 67497 0.135E-01 0.415E-02
DAV: 5 -0.356388358597E+03 -0.15716E-04 -0.25492E-04 67173 0.554E-02 0.211E-02
DAV: 6 -0.356388358069E+03 0.52801E-06 -0.24851E-05 49938 0.189E-02
31 F= -.35638836E+03 E0= -.35639302E+03 d E =-.181574E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.356493957989E+03 -0.10560E+00 -0.40628E+01 57720 0.210E+01 0.134E+00
DAV: 2 -0.356564819714E+03 -0.70862E-01 -0.88668E-01 66984 0.277E+00 0.921E-01
DAV: 3 -0.356556863953E+03 0.79558E-02 -0.21658E-02 70449 0.578E-01 0.511E-01
DAV: 4 -0.356555313477E+03 0.15505E-02 -0.92957E-03 67497 0.362E-01 0.136E-01
DAV: 5 -0.356555493206E+03 -0.17973E-03 -0.17901E-03 67299 0.139E-01 0.580E-02
DAV: 6 -0.356555491946E+03 0.12591E-05 -0.19832E-04 68361 0.505E-02 0.295E-02
DAV: 7 -0.356555483352E+03 0.85946E-05 -0.30872E-05 56355 0.272E-02
32 F= -.35655548E+03 E0= -.35656006E+03 d E =-.167125E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.356562048350E+03 -0.65564E-02 -0.10992E+01 57720 0.109E+01 0.684E-01
DAV: 2 -0.356581424523E+03 -0.19376E-01 -0.24369E-01 66750 0.144E+00 0.484E-01
DAV: 3 -0.356579178139E+03 0.22464E-02 -0.59608E-03 70467 0.303E-01 0.264E-01
DAV: 4 -0.356578760315E+03 0.41782E-03 -0.25469E-03 68253 0.191E-01 0.686E-02
DAV: 5 -0.356578807760E+03 -0.47445E-04 -0.49665E-04 66480 0.726E-02 0.309E-02
DAV: 6 -0.356578807352E+03 0.40817E-06 -0.57146E-05 67470 0.270E-02
33 F= -.35657881E+03 E0= -.35658334E+03 d E =-.190449E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.356667431832E+03 -0.88624E-01 -0.34848E+01 57720 0.195E+01 0.125E+00
DAV: 2 -0.356727864812E+03 -0.60433E-01 -0.77173E-01 67074 0.261E+00 0.853E-01
DAV: 3 -0.356721394934E+03 0.64699E-02 -0.19184E-02 70980 0.514E-01 0.473E-01
DAV: 4 -0.356720206003E+03 0.11889E-02 -0.65951E-03 66624 0.317E-01 0.129E-01
DAV: 5 -0.356720335411E+03 -0.12941E-03 -0.12780E-03 68451 0.119E-01 0.513E-02
DAV: 6 -0.356720328885E+03 0.65253E-05 -0.17644E-04 68487 0.474E-02 0.269E-02
DAV: 7 -0.356720317916E+03 0.10969E-04 -0.22330E-05 50586 0.260E-02 0.120E-02
DAV: 8 -0.356720317379E+03 0.53698E-06 -0.19854E-05 46275 0.156E-02
34 F= -.35672032E+03 E0= -.35672479E+03 d E =-.141510E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.356724653969E+03 -0.43361E-02 -0.94731E+00 57720 0.102E+01 0.643E-01
DAV: 2 -0.356740772461E+03 -0.16118E-01 -0.20656E-01 66993 0.134E+00 0.442E-01
DAV: 3 -0.356738947850E+03 0.18246E-02 -0.52233E-03 70881 0.272E-01 0.237E-01
DAV: 4 -0.356738641611E+03 0.30624E-03 -0.18464E-03 66561 0.166E-01 0.627E-02
DAV: 5 -0.356738676156E+03 -0.34546E-04 -0.35008E-04 68775 0.620E-02 0.271E-02
DAV: 6 -0.356738673275E+03 0.28810E-05 -0.44816E-05 66084 0.242E-02
35 F= -.35673867E+03 E0= -.35674312E+03 d E =-.159866E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.356812138916E+03 -0.73463E-01 -0.30037E+01 57720 0.180E+01 0.118E+00
DAV: 2 -0.356864915657E+03 -0.52777E-01 -0.67059E-01 67281 0.241E+00 0.797E-01
DAV: 3 -0.356859371975E+03 0.55437E-02 -0.16067E-02 70980 0.490E-01 0.447E-01
DAV: 4 -0.356858422848E+03 0.94913E-03 -0.78485E-03 66354 0.332E-01 0.120E-01
DAV: 5 -0.356858527190E+03 -0.10434E-03 -0.13251E-03 68343 0.131E-01 0.531E-02
DAV: 6 -0.356858527781E+03 -0.59136E-06 -0.18402E-04 66876 0.467E-02 0.268E-02
DAV: 7 -0.356858521441E+03 0.63402E-05 -0.29059E-05 53025 0.268E-02
36 F= -.35685852E+03 E0= -.35686288E+03 d E =-.119848E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.356860825818E+03 -0.22980E-02 -0.13050E+01 57720 0.119E+01 0.766E-01
DAV: 2 -0.356883425430E+03 -0.22600E-01 -0.28741E-01 67281 0.158E+00 0.525E-01
DAV: 3 -0.356880940164E+03 0.24853E-02 -0.69488E-03 70980 0.326E-01 0.291E-01
DAV: 4 -0.356880520112E+03 0.42005E-03 -0.34587E-03 66264 0.220E-01 0.762E-02
DAV: 5 -0.356880563386E+03 -0.43274E-04 -0.58680E-04 68658 0.867E-02 0.350E-02
DAV: 6 -0.356880562817E+03 0.56931E-06 -0.81791E-05 65967 0.314E-02
37 F= -.35688056E+03 E0= -.35688487E+03 d E =-.141890E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.356954157450E+03 -0.73594E-01 -0.30784E+01 57720 0.181E+01 0.119E+00
DAV: 2 -0.357006062665E+03 -0.51905E-01 -0.66536E-01 66345 0.241E+00 0.816E-01
DAV: 3 -0.357000618006E+03 0.54447E-02 -0.15819E-02 70476 0.502E-01 0.467E-01
DAV: 4 -0.356999531017E+03 0.10870E-02 -0.89835E-03 66291 0.352E-01 0.113E-01
DAV: 5 -0.356999613635E+03 -0.82619E-04 -0.15826E-03 68973 0.153E-01 0.532E-02
DAV: 6 -0.356999614594E+03 -0.95921E-06 -0.21216E-04 68658 0.493E-02 0.287E-02
DAV: 7 -0.356999610948E+03 0.36462E-05 -0.33209E-05 57651 0.228E-02
38 F= -.35699961E+03 E0= -.35700386E+03 d E =-.119048E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.356998191416E+03 0.14232E-02 -0.20734E+01 57720 0.149E+01 0.975E-01
DAV: 2 -0.357033598001E+03 -0.35407E-01 -0.45348E-01 66246 0.196E+00 0.674E-01
DAV: 3 -0.357029829578E+03 0.37684E-02 -0.10773E-02 70440 0.410E-01 0.384E-01
DAV: 4 -0.357029041724E+03 0.78785E-03 -0.60474E-03 65976 0.290E-01 0.919E-02
DAV: 5 -0.357029096945E+03 -0.55221E-04 -0.11242E-03 69351 0.126E-01 0.434E-02
DAV: 6 -0.357029096217E+03 0.72761E-06 -0.14139E-04 68406 0.402E-02 0.238E-02
DAV: 7 -0.357029093089E+03 0.31286E-05 -0.21287E-05 45744 0.192E-02
39 F= -.35702909E+03 E0= -.35703330E+03 d E =-.148530E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357094869772E+03 -0.65774E-01 -0.33879E+01 57720 0.191E+01 0.124E+00
DAV: 2 -0.357152564670E+03 -0.57695E-01 -0.72908E-01 66399 0.250E+00 0.823E-01
DAV: 3 -0.357147056230E+03 0.55084E-02 -0.15214E-02 70863 0.474E-01 0.463E-01
DAV: 4 -0.357146111086E+03 0.94514E-03 -0.75860E-03 66534 0.337E-01 0.105E-01
DAV: 5 -0.357146224408E+03 -0.11332E-03 -0.13935E-03 66921 0.132E-01 0.498E-02
DAV: 6 -0.357146224393E+03 0.15056E-07 -0.16877E-04 68847 0.436E-02 0.250E-02
DAV: 7 -0.357146217684E+03 0.67083E-05 -0.20396E-05 49272 0.238E-02
40 F= -.35714622E+03 E0= -.35715040E+03 d E =-.117125E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357135691871E+03 0.10533E-01 -0.30710E+01 57720 0.182E+01 0.118E+00
DAV: 2 -0.357187417285E+03 -0.51725E-01 -0.65324E-01 66372 0.237E+00 0.781E-01
DAV: 3 -0.357182387798E+03 0.50295E-02 -0.13892E-02 70899 0.453E-01 0.436E-01
DAV: 4 -0.357181536219E+03 0.85158E-03 -0.67398E-03 66462 0.315E-01 0.990E-02
DAV: 5 -0.357181641593E+03 -0.10537E-03 -0.12430E-03 67110 0.122E-01 0.473E-02
DAV: 6 -0.357181640361E+03 0.12317E-05 -0.13928E-04 68793 0.395E-02 0.234E-02
DAV: 7 -0.357181634270E+03 0.60915E-05 -0.17661E-05 46851 0.223E-02
41 F= -.35718163E+03 E0= -.35718580E+03 d E =-.152541E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357229476455E+03 -0.47836E-01 -0.43767E+01 57720 0.217E+01 0.143E+00
DAV: 2 -0.357302670758E+03 -0.73194E-01 -0.92171E-01 66309 0.282E+00 0.942E-01
DAV: 3 -0.357295169211E+03 0.75015E-02 -0.21003E-02 70962 0.571E-01 0.527E-01
DAV: 4 -0.357293916291E+03 0.12529E-02 -0.93501E-03 66399 0.362E-01 0.131E-01
DAV: 5 -0.357294087280E+03 -0.17099E-03 -0.16564E-03 64968 0.139E-01 0.556E-02
DAV: 6 -0.357294088455E+03 -0.11750E-05 -0.17659E-04 70260 0.467E-02 0.262E-02
DAV: 7 -0.357294081920E+03 0.65350E-05 -0.26018E-05 49209 0.254E-02
42 F= -.35729408E+03 E0= -.35729821E+03 d E =-.112448E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357292702150E+03 0.13863E-02 -0.10233E+01 57720 0.105E+01 0.670E-01
DAV: 2 -0.357309187142E+03 -0.16485E-01 -0.20897E-01 66219 0.135E+00 0.452E-01
DAV: 3 -0.357307369876E+03 0.18173E-02 -0.49044E-03 70926 0.276E-01 0.239E-01
DAV: 4 -0.357307142072E+03 0.22780E-03 -0.21363E-03 66210 0.172E-01 0.574E-02
DAV: 5 -0.357307173658E+03 -0.31586E-04 -0.35863E-04 68325 0.650E-02 0.268E-02
DAV: 6 -0.357307173273E+03 0.38501E-06 -0.38352E-05 60234 0.223E-02
43 F= -.35730717E+03 E0= -.35731129E+03 d E =-.125539E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357344357036E+03 -0.37183E-01 -0.33991E+01 57720 0.192E+01 0.125E+00
DAV: 2 -0.357400897304E+03 -0.56540E-01 -0.72324E-01 66291 0.252E+00 0.855E-01
DAV: 3 -0.357394651218E+03 0.62461E-02 -0.18500E-02 70944 0.520E-01 0.484E-01
DAV: 4 -0.357393257656E+03 0.13936E-02 -0.76583E-03 66048 0.321E-01 0.122E-01
DAV: 5 -0.357393411877E+03 -0.15422E-03 -0.14058E-03 66867 0.127E-01 0.514E-02
DAV: 6 -0.357393407973E+03 0.39048E-05 -0.15302E-04 68748 0.439E-02 0.248E-02
DAV: 7 -0.357393402971E+03 0.50013E-05 -0.22233E-05 49182 0.221E-02
44 F= -.35739340E+03 E0= -.35739749E+03 d E =-.862297E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357394047607E+03 -0.63963E-03 -0.20467E+00 57738 0.471E+00 0.299E-01
DAV: 2 -0.357397406674E+03 -0.33591E-02 -0.43382E-02 66291 0.610E-01 0.208E-01
DAV: 3 -0.357397020241E+03 0.38643E-03 -0.11148E-03 69234 0.127E-01 0.111E-01
DAV: 4 -0.357396954341E+03 0.65901E-04 -0.44647E-04 66273 0.775E-02 0.271E-02
DAV: 5 -0.357396961961E+03 -0.76207E-05 -0.79019E-05 68622 0.299E-02
45 F= -.35739696E+03 E0= -.35740104E+03 d E =-.897887E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357445203563E+03 -0.48249E-01 -0.24450E+01 57720 0.162E+01 0.104E+00
DAV: 2 -0.357483623362E+03 -0.38420E-01 -0.49861E-01 66615 0.209E+00 0.694E-01
DAV: 3 -0.357479452138E+03 0.41712E-02 -0.11733E-02 70971 0.406E-01 0.376E-01
DAV: 4 -0.357478856931E+03 0.59521E-03 -0.51031E-03 66363 0.278E-01 0.892E-02
DAV: 5 -0.357478944595E+03 -0.87664E-04 -0.96482E-04 68469 0.106E-01 0.426E-02
DAV: 6 -0.357478943493E+03 0.11021E-05 -0.12332E-04 67398 0.385E-02 0.218E-02
DAV: 7 -0.357478937482E+03 0.60112E-05 -0.19319E-05 49056 0.226E-02
46 F= -.35747894E+03 E0= -.35748299E+03 d E =-.819755E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357478691642E+03 0.25185E-03 -0.15736E+01 57720 0.130E+01 0.826E-01
DAV: 2 -0.357503191150E+03 -0.24500E-01 -0.31904E-01 66516 0.167E+00 0.557E-01
DAV: 3 -0.357500456995E+03 0.27342E-02 -0.76435E-03 70953 0.330E-01 0.297E-01
DAV: 4 -0.357500086895E+03 0.37010E-03 -0.33117E-03 66336 0.224E-01 0.708E-02
DAV: 5 -0.357500143419E+03 -0.56524E-04 -0.63822E-04 68604 0.854E-02 0.349E-02
DAV: 6 -0.357500142080E+03 0.13396E-05 -0.77076E-05 67344 0.309E-02
47 F= -.35750014E+03 E0= -.35750418E+03 d E =-.103180E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357548364641E+03 -0.48221E-01 -0.15006E+01 57720 0.127E+01 0.814E-01
DAV: 2 -0.357571750251E+03 -0.23386E-01 -0.30147E-01 66345 0.163E+00 0.545E-01
DAV: 3 -0.357569202067E+03 0.25482E-02 -0.69449E-03 70980 0.321E-01 0.296E-01
DAV: 4 -0.357568837725E+03 0.36434E-03 -0.34134E-03 66300 0.218E-01 0.673E-02
DAV: 5 -0.357568880979E+03 -0.43255E-04 -0.60405E-04 68649 0.881E-02 0.343E-02
DAV: 6 -0.357568880683E+03 0.29667E-06 -0.69487E-05 67929 0.288E-02
48 F= -.35756888E+03 E0= -.35757290E+03 d E =-.687386E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357556939183E+03 0.11942E-01 -0.39910E+01 57720 0.208E+01 0.135E+00
DAV: 2 -0.357619795067E+03 -0.62856E-01 -0.80614E-01 66336 0.267E+00 0.891E-01
DAV: 3 -0.357613102993E+03 0.66921E-02 -0.18670E-02 71061 0.520E-01 0.496E-01
DAV: 4 -0.357611910490E+03 0.11925E-02 -0.85680E-03 66327 0.350E-01 0.116E-01
DAV: 5 -0.357612063589E+03 -0.15310E-03 -0.16156E-03 68280 0.140E-01 0.554E-02
DAV: 6 -0.357612060839E+03 0.27493E-05 -0.17713E-04 68568 0.469E-02 0.279E-02
DAV: 7 -0.357612055692E+03 0.51470E-05 -0.33283E-05 56238 0.260E-02
49 F= -.35761206E+03 E0= -.35761606E+03 d E =-.111914E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357644746382E+03 -0.32686E-01 -0.19334E+01 57720 0.144E+01 0.927E-01
DAV: 2 -0.357675276272E+03 -0.30530E-01 -0.39276E-01 66273 0.186E+00 0.612E-01
DAV: 3 -0.357672124808E+03 0.31515E-02 -0.10500E-02 70854 0.373E-01 0.330E-01
DAV: 4 -0.357671687584E+03 0.43722E-03 -0.35021E-03 67227 0.228E-01 0.875E-02
DAV: 5 -0.357671762399E+03 -0.74815E-04 -0.64176E-04 68280 0.867E-02 0.370E-02
DAV: 6 -0.357671763716E+03 -0.13174E-05 -0.86380E-05 66246 0.321E-02
50 F= -.35767176E+03 E0= -.35767576E+03 d E =-.597080E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357670799818E+03 0.96258E-03 -0.10003E+01 57720 0.104E+01 0.664E-01
DAV: 2 -0.357686654408E+03 -0.15855E-01 -0.20363E-01 66273 0.134E+00 0.439E-01
DAV: 3 -0.357685053319E+03 0.16011E-02 -0.53969E-03 70746 0.267E-01 0.233E-01
DAV: 4 -0.357684864399E+03 0.18892E-03 -0.18177E-03 67353 0.164E-01 0.616E-02
DAV: 5 -0.357684899745E+03 -0.35346E-04 -0.31829E-04 68433 0.618E-02 0.267E-02
DAV: 6 -0.357684900190E+03 -0.44498E-06 -0.44188E-05 62151 0.228E-02
51 F= -.35768490E+03 E0= -.35768890E+03 d E =-.728445E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357720497956E+03 -0.35598E-01 -0.16863E+01 57720 0.134E+01 0.855E-01
DAV: 2 -0.357747739648E+03 -0.27242E-01 -0.34620E-01 66291 0.174E+00 0.566E-01
DAV: 3 -0.357745175537E+03 0.25641E-02 -0.79134E-03 70566 0.328E-01 0.308E-01
DAV: 4 -0.357744787082E+03 0.38846E-03 -0.33811E-03 66282 0.219E-01 0.692E-02
DAV: 5 -0.357744849835E+03 -0.62754E-04 -0.67844E-04 68595 0.912E-02 0.349E-02
DAV: 6 -0.357744848099E+03 0.17362E-05 -0.59672E-05 66822 0.277E-02
52 F= -.35774485E+03 E0= -.35774885E+03 d E =-.599479E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357732369204E+03 0.12481E-01 -0.26959E+01 57720 0.170E+01 0.109E+00
DAV: 2 -0.357776343682E+03 -0.43974E-01 -0.55797E-01 66291 0.221E+00 0.721E-01
DAV: 3 -0.357772202446E+03 0.41412E-02 -0.12891E-02 70611 0.418E-01 0.396E-01
DAV: 4 -0.357771500567E+03 0.70188E-03 -0.54980E-03 66318 0.279E-01 0.896E-02
DAV: 5 -0.357771610887E+03 -0.11032E-03 -0.11270E-03 68334 0.117E-01 0.452E-02
DAV: 6 -0.357771607472E+03 0.34154E-05 -0.10199E-04 68703 0.363E-02 0.237E-02
DAV: 7 -0.357771602569E+03 0.49024E-05 -0.15874E-05 40623 0.189E-02
53 F= -.35777160E+03 E0= -.35777561E+03 d E =-.867024E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357802960851E+03 -0.31353E-01 -0.10793E+01 57720 0.108E+01 0.673E-01
DAV: 2 -0.357820926220E+03 -0.17965E-01 -0.22398E-01 66273 0.138E+00 0.455E-01
DAV: 3 -0.357819174217E+03 0.17520E-02 -0.48004E-03 69882 0.269E-01 0.241E-01
DAV: 4 -0.357818974211E+03 0.20001E-03 -0.22471E-03 66435 0.181E-01 0.531E-02
DAV: 5 -0.357819018408E+03 -0.44196E-04 -0.46854E-04 68154 0.732E-02 0.302E-02
DAV: 6 -0.357819017266E+03 0.11419E-05 -0.34577E-05 56634 0.227E-02
54 F= -.35781902E+03 E0= -.35782303E+03 d E =-.474147E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357807343788E+03 0.11675E-01 -0.30785E+01 57720 0.182E+01 0.115E+00
DAV: 2 -0.357858666479E+03 -0.51323E-01 -0.63851E-01 66300 0.234E+00 0.764E-01
DAV: 3 -0.357853833193E+03 0.48333E-02 -0.13820E-02 69882 0.449E-01 0.407E-01
DAV: 4 -0.357853238060E+03 0.59513E-03 -0.59972E-03 66768 0.298E-01 0.899E-02
DAV: 5 -0.357853371910E+03 -0.13385E-03 -0.12678E-03 67362 0.119E-01 0.501E-02
DAV: 6 -0.357853369234E+03 0.26764E-05 -0.10302E-04 68307 0.385E-02 0.239E-02
DAV: 7 -0.357853365467E+03 0.37665E-05 -0.19756E-05 43206 0.209E-02
55 F= -.35785337E+03 E0= -.35785737E+03 d E =-.817629E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357883266014E+03 -0.29897E-01 -0.65301E+00 57720 0.841E+00 0.539E-01
DAV: 2 -0.357894885331E+03 -0.11619E-01 -0.14512E-01 65805 0.111E+00 0.357E-01
DAV: 3 -0.357893742419E+03 0.11429E-02 -0.34553E-03 68901 0.214E-01 0.188E-01
DAV: 4 -0.357893576301E+03 0.16612E-03 -0.13655E-03 66039 0.142E-01 0.433E-02
DAV: 5 -0.357893599811E+03 -0.23510E-04 -0.26784E-04 68073 0.567E-02 0.239E-02
DAV: 6 -0.357893598773E+03 0.10373E-05 -0.24027E-05 47229 0.176E-02
56 F= -.35789360E+03 E0= -.35789760E+03 d E =-.402333E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357895265018E+03 -0.16652E-02 -0.11728E+01 57720 0.113E+01 0.723E-01
DAV: 2 -0.357916193432E+03 -0.20928E-01 -0.26098E-01 65850 0.149E+00 0.476E-01
DAV: 3 -0.357914169802E+03 0.20236E-02 -0.60854E-03 69414 0.284E-01 0.251E-01
DAV: 4 -0.357913876806E+03 0.29300E-03 -0.24555E-03 66039 0.190E-01 0.574E-02
DAV: 5 -0.357913917351E+03 -0.40545E-04 -0.47873E-04 67785 0.758E-02 0.317E-02
DAV: 6 -0.357913915551E+03 0.18001E-05 -0.47114E-05 64608 0.235E-02
57 F= -.35791392E+03 E0= -.35791790E+03 d E =-.605501E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357943239633E+03 -0.29322E-01 -0.88859E+00 57726 0.973E+00 0.623E-01
DAV: 2 -0.357958460446E+03 -0.15221E-01 -0.19139E-01 66093 0.127E+00 0.417E-01
DAV: 3 -0.357957100847E+03 0.13596E-02 -0.45993E-03 69702 0.252E-01 0.226E-01
DAV: 4 -0.357956925545E+03 0.17530E-03 -0.17491E-03 66048 0.160E-01 0.590E-02
DAV: 5 -0.357956966898E+03 -0.41353E-04 -0.35231E-04 67740 0.642E-02 0.284E-02
DAV: 6 -0.357956967122E+03 -0.22330E-06 -0.48798E-05 63276 0.242E-02
58 F= -.35795697E+03 E0= -.35796095E+03 d E =-.430516E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.357949296902E+03 0.76700E-02 -0.20866E+01 57720 0.149E+01 0.957E-01
DAV: 2 -0.357985528475E+03 -0.36232E-01 -0.45484E-01 66147 0.195E+00 0.643E-01
DAV: 3 -0.357982304038E+03 0.32244E-02 -0.10969E-02 69828 0.393E-01 0.353E-01
DAV: 4 -0.357981820135E+03 0.48390E-03 -0.42970E-03 66336 0.249E-01 0.923E-02
DAV: 5 -0.357981924951E+03 -0.10482E-03 -0.88637E-04 66597 0.101E-01 0.444E-02
DAV: 6 -0.357981924633E+03 0.31882E-06 -0.11342E-04 68622 0.371E-02 0.237E-02
DAV: 7 -0.357981920264E+03 0.43687E-05 -0.16634E-05 46446 0.204E-02
59 F= -.35798192E+03 E0= -.35798590E+03 d E =-.680047E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358006505301E+03 -0.24581E-01 -0.14249E+01 57720 0.123E+01 0.789E-01
DAV: 2 -0.358030714896E+03 -0.24210E-01 -0.30645E-01 66633 0.159E+00 0.533E-01
DAV: 3 -0.358028215250E+03 0.24996E-02 -0.65346E-03 70251 0.304E-01 0.285E-01
DAV: 4 -0.358027885872E+03 0.32938E-03 -0.31745E-03 66174 0.210E-01 0.633E-02
DAV: 5 -0.358027942297E+03 -0.56424E-04 -0.59369E-04 67704 0.862E-02 0.331E-02
DAV: 6 -0.358027942647E+03 -0.35005E-06 -0.59897E-05 66201 0.265E-02
60 F= -.35802794E+03 E0= -.35803193E+03 d E =-.460224E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358026310653E+03 0.16316E-02 -0.80385E+00 57720 0.919E+00 0.592E-01
DAV: 2 -0.358039760850E+03 -0.13450E-01 -0.17055E-01 66687 0.119E+00 0.398E-01
DAV: 3 -0.358038383399E+03 0.13775E-02 -0.36761E-03 70062 0.228E-01 0.211E-01
DAV: 4 -0.358038225204E+03 0.15820E-03 -0.17273E-03 66093 0.155E-01 0.473E-02
DAV: 5 -0.358038254958E+03 -0.29754E-04 -0.31789E-04 67857 0.635E-02 0.246E-02
DAV: 6 -0.358038254969E+03 -0.10888E-07 -0.32907E-05 56445 0.200E-02
61 F= -.35803825E+03 E0= -.35804224E+03 d E =-.563347E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358055830792E+03 -0.17576E-01 -0.17545E+01 57720 0.136E+01 0.893E-01
DAV: 2 -0.358085230316E+03 -0.29400E-01 -0.37415E-01 66669 0.178E+00 0.584E-01
DAV: 3 -0.358082205447E+03 0.30249E-02 -0.92914E-03 70746 0.352E-01 0.306E-01
DAV: 4 -0.358081915248E+03 0.29020E-03 -0.33959E-03 66246 0.220E-01 0.741E-02
DAV: 5 -0.358081988002E+03 -0.72753E-04 -0.60634E-04 66975 0.855E-02 0.347E-02
DAV: 6 -0.358081987809E+03 0.19205E-06 -0.53625E-05 65076 0.241E-02
62 F= -.35808199E+03 E0= -.35808597E+03 d E =-.437328E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358081985573E+03 0.24283E-05 -0.25576E+00 57720 0.519E+00 0.341E-01
DAV: 2 -0.358086202649E+03 -0.42171E-02 -0.53990E-02 66759 0.677E-01 0.222E-01
DAV: 3 -0.358085783861E+03 0.41879E-03 -0.13330E-03 69009 0.134E-01 0.115E-01
DAV: 4 -0.358085755748E+03 0.28113E-04 -0.49050E-04 66345 0.837E-02 0.284E-02
DAV: 5 -0.358085765851E+03 -0.10103E-04 -0.84862E-05 68208 0.324E-02 0.133E-02
DAV: 6 -0.358085765737E+03 0.11403E-06 -0.72585E-06 39858 0.939E-03
63 F= -.35808577E+03 E0= -.35808975E+03 d E =-.475108E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358107216517E+03 -0.21451E-01 -0.11740E+01 57720 0.111E+01 0.730E-01
DAV: 2 -0.358126552976E+03 -0.19336E-01 -0.24799E-01 66228 0.145E+00 0.497E-01
DAV: 3 -0.358124176062E+03 0.23769E-02 -0.58249E-03 69657 0.295E-01 0.254E-01
DAV: 4 -0.358123863704E+03 0.31236E-03 -0.28118E-03 66075 0.195E-01 0.555E-02
DAV: 5 -0.358123903942E+03 -0.40238E-04 -0.51226E-04 68325 0.768E-02 0.325E-02
DAV: 6 -0.358123901923E+03 0.20196E-05 -0.38571E-05 61476 0.222E-02
64 F= -.35812390E+03 E0= -.35812788E+03 d E =-.381362E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358124656432E+03 -0.75249E-03 -0.23044E+00 57726 0.494E+00 0.324E-01
DAV: 2 -0.358128510037E+03 -0.38536E-02 -0.49360E-02 66165 0.645E-01 0.221E-01
DAV: 3 -0.358128049221E+03 0.46082E-03 -0.11407E-03 67947 0.132E-01 0.114E-01
DAV: 4 -0.358127983006E+03 0.66215E-04 -0.56739E-04 66399 0.877E-02 0.250E-02
DAV: 5 -0.358127991198E+03 -0.81912E-05 -0.10537E-04 68451 0.349E-02 0.146E-02
DAV: 6 -0.358127990660E+03 0.53737E-06 -0.70824E-06 39921 0.101E-02
65 F= -.35812799E+03 E0= -.35813196E+03 d E =-.422249E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358151688439E+03 -0.23697E-01 -0.11332E+01 57720 0.110E+01 0.723E-01
DAV: 2 -0.358169420285E+03 -0.17732E-01 -0.23112E-01 65967 0.142E+00 0.490E-01
DAV: 3 -0.358167247095E+03 0.21732E-02 -0.56788E-03 69117 0.295E-01 0.243E-01
DAV: 4 -0.358167088978E+03 0.15812E-03 -0.24622E-03 66399 0.180E-01 0.559E-02
DAV: 5 -0.358167121795E+03 -0.32817E-04 -0.44027E-04 68325 0.718E-02 0.311E-02
DAV: 6 -0.358167120250E+03 0.15450E-05 -0.31895E-05 53979 0.227E-02
66 F= -.35816712E+03 E0= -.35817110E+03 d E =-.391296E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358167780100E+03 -0.65830E-03 -0.53564E+00 57720 0.758E+00 0.496E-01
DAV: 2 -0.358176063260E+03 -0.82832E-02 -0.10811E-01 65922 0.972E-01 0.336E-01
DAV: 3 -0.358175051051E+03 0.10122E-02 -0.26909E-03 68856 0.204E-01 0.165E-01
DAV: 4 -0.358174981924E+03 0.69126E-04 -0.11522E-03 66426 0.124E-01 0.385E-02
DAV: 5 -0.358174996783E+03 -0.14859E-04 -0.20572E-04 68442 0.491E-02 0.216E-02
DAV: 6 -0.358174996020E+03 0.76256E-06 -0.14648E-05 41298 0.160E-02
67 F= -.35817500E+03 E0= -.35817897E+03 d E =-.470054E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358197008299E+03 -0.22012E-01 -0.10114E+01 57720 0.104E+01 0.707E-01
DAV: 2 -0.358212158652E+03 -0.15150E-01 -0.20360E-01 66192 0.135E+00 0.464E-01
DAV: 3 -0.358210291689E+03 0.18670E-02 -0.59558E-03 68901 0.283E-01 0.225E-01
DAV: 4 -0.358210183607E+03 0.10808E-03 -0.18655E-03 66273 0.157E-01 0.553E-02
DAV: 5 -0.358210212547E+03 -0.28939E-04 -0.28038E-04 67866 0.560E-02 0.266E-02
DAV: 6 -0.358210211542E+03 0.10050E-05 -0.27999E-05 51261 0.197E-02
68 F= -.35821021E+03 E0= -.35821419E+03 d E =-.352155E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358211393321E+03 -0.11808E-02 -0.39058E+00 57720 0.647E+00 0.439E-01
DAV: 2 -0.358217223897E+03 -0.58306E-02 -0.78502E-02 66219 0.837E-01 0.288E-01
DAV: 3 -0.358216510312E+03 0.71359E-03 -0.23081E-03 68901 0.177E-01 0.138E-01
DAV: 4 -0.358216476480E+03 0.33832E-04 -0.72566E-04 66345 0.979E-02 0.346E-02
DAV: 5 -0.358216487340E+03 -0.10859E-04 -0.10694E-04 68145 0.348E-02 0.167E-02
DAV: 6 -0.358216486852E+03 0.48742E-06 -0.10221E-05 40101 0.123E-02
69 F= -.35821649E+03 E0= -.35822046E+03 d E =-.414908E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358238163952E+03 -0.21677E-01 -0.83643E+00 57720 0.944E+00 0.655E-01
DAV: 2 -0.358249981777E+03 -0.11818E-01 -0.16636E-01 66327 0.122E+00 0.434E-01
DAV: 3 -0.358248245791E+03 0.17360E-02 -0.50919E-03 68973 0.272E-01 0.212E-01
DAV: 4 -0.358248100666E+03 0.14512E-03 -0.18839E-03 66030 0.155E-01 0.556E-02
DAV: 5 -0.358248122927E+03 -0.22261E-04 -0.29737E-04 68937 0.625E-02 0.268E-02
DAV: 6 -0.358248121077E+03 0.18502E-05 -0.34126E-05 58920 0.221E-02
70 F= -.35824812E+03 E0= -.35825210E+03 d E =-.316342E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358249760740E+03 -0.16378E-02 -0.27239E+00 57720 0.539E+00 0.374E-01
DAV: 2 -0.358253689518E+03 -0.39288E-02 -0.54977E-02 66336 0.701E-01 0.249E-01
DAV: 3 -0.358253121159E+03 0.56836E-03 -0.16717E-03 68937 0.156E-01 0.122E-01
DAV: 4 -0.358253070450E+03 0.50709E-04 -0.62727E-04 66192 0.896E-02 0.321E-02
DAV: 5 -0.358253077429E+03 -0.69782E-05 -0.10085E-04 68784 0.365E-02 0.156E-02
DAV: 6 -0.358253076573E+03 0.85506E-06 -0.10778E-05 40137 0.131E-02
71 F= -.35825308E+03 E0= -.35825705E+03 d E =-.365897E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358274721116E+03 -0.21644E-01 -0.96705E+00 57720 0.101E+01 0.709E-01
DAV: 2 -0.358287510589E+03 -0.12789E-01 -0.18662E-01 66300 0.130E+00 0.473E-01
DAV: 3 -0.358285328117E+03 0.21825E-02 -0.65747E-03 69234 0.320E-01 0.219E-01
DAV: 4 -0.358285235223E+03 0.92894E-04 -0.23200E-03 66471 0.169E-01 0.658E-02
DAV: 5 -0.358285258595E+03 -0.23372E-04 -0.30925E-04 69009 0.663E-02 0.299E-02
DAV: 6 -0.358285256550E+03 0.20446E-05 -0.45086E-05 66138 0.252E-02
72 F= -.35828526E+03 E0= -.35828924E+03 d E =-.321800E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358286824906E+03 -0.15663E-02 -0.31228E+00 57720 0.576E+00 0.402E-01
DAV: 2 -0.358290907344E+03 -0.40824E-02 -0.59678E-02 66300 0.738E-01 0.268E-01
DAV: 3 -0.358290214498E+03 0.69285E-03 -0.21449E-03 69162 0.183E-01 0.122E-01
DAV: 4 -0.358290190036E+03 0.24462E-04 -0.73587E-04 66840 0.957E-02 0.373E-02
DAV: 5 -0.358290196688E+03 -0.66524E-05 -0.97674E-05 68568 0.377E-02
73 F= -.35829020E+03 E0= -.35829418E+03 d E =-.371201E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358312666760E+03 -0.22477E-01 -0.87111E+00 57720 0.961E+00 0.671E-01
DAV: 2 -0.358323435132E+03 -0.10768E-01 -0.16129E-01 66579 0.122E+00 0.444E-01
DAV: 3 -0.358321496738E+03 0.19384E-02 -0.59902E-03 68649 0.287E-01 0.191E-01
DAV: 4 -0.358321470358E+03 0.26380E-04 -0.17052E-03 67272 0.145E-01 0.558E-02
DAV: 5 -0.358321494106E+03 -0.23748E-04 -0.20967E-04 69009 0.494E-02 0.247E-02
DAV: 6 -0.358321492969E+03 0.11373E-05 -0.22780E-05 47697 0.178E-02
74 F= -.35832149E+03 E0= -.35832549E+03 d E =-.312963E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358323955914E+03 -0.24618E-02 -0.52029E+00 57720 0.742E+00 0.517E-01
DAV: 2 -0.358330265759E+03 -0.63098E-02 -0.95643E-02 66696 0.940E-01 0.341E-01
DAV: 3 -0.358329098629E+03 0.11671E-02 -0.35676E-03 68649 0.222E-01 0.145E-01
DAV: 4 -0.358329090956E+03 0.76725E-05 -0.10304E-03 67983 0.111E-01 0.428E-02
DAV: 5 -0.358329104121E+03 -0.13165E-04 -0.12074E-04 66597 0.380E-02 0.188E-02
DAV: 6 -0.358329103177E+03 0.94448E-06 -0.12763E-05 40524 0.137E-02
75 F= -.35832910E+03 E0= -.35833310E+03 d E =-.389065E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358354033326E+03 -0.24929E-01 -0.10453E+01 57720 0.105E+01 0.724E-01
DAV: 2 -0.358366360484E+03 -0.12327E-01 -0.18523E-01 66300 0.130E+00 0.483E-01
DAV: 3 -0.358363958454E+03 0.24020E-02 -0.71076E-03 68838 0.327E-01 0.205E-01
DAV: 4 -0.358363927789E+03 0.30665E-04 -0.21447E-03 67254 0.161E-01 0.638E-02
DAV: 5 -0.358363952040E+03 -0.24251E-04 -0.26723E-04 68415 0.564E-02 0.301E-02
DAV: 6 -0.358363952634E+03 -0.59368E-06 -0.40033E-05 63222 0.242E-02
76 F= -.35836395E+03 E0= -.35836795E+03 d E =-.348495E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358366286944E+03 -0.23349E-02 -0.75232E+00 57720 0.893E+00 0.614E-01
DAV: 2 -0.358375294408E+03 -0.90075E-02 -0.13439E-01 66300 0.111E+00 0.411E-01
DAV: 3 -0.358373563454E+03 0.17310E-02 -0.51986E-03 68793 0.281E-01 0.176E-01
DAV: 4 -0.358373531697E+03 0.31758E-04 -0.15460E-03 67461 0.139E-01 0.544E-02
DAV: 5 -0.358373550188E+03 -0.18492E-04 -0.20319E-04 68118 0.491E-02 0.259E-02
DAV: 6 -0.358373550244E+03 -0.55770E-07 -0.30440E-05 54942 0.218E-02
77 F= -.35837355E+03 E0= -.35837754E+03 d E =-.444471E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358396169851E+03 -0.22620E-01 -0.11817E+01 57720 0.112E+01 0.778E-01
DAV: 2 -0.358409645416E+03 -0.13476E-01 -0.20868E-01 66534 0.139E+00 0.524E-01
DAV: 3 -0.358406789406E+03 0.28560E-02 -0.81883E-03 70449 0.359E-01 0.226E-01
DAV: 4 -0.358406727077E+03 0.62329E-04 -0.25848E-03 66633 0.175E-01 0.681E-02
DAV: 5 -0.358406755390E+03 -0.28313E-04 -0.32717E-04 69486 0.627E-02 0.337E-02
DAV: 6 -0.358406755353E+03 0.37020E-07 -0.44671E-05 65202 0.276E-02
78 F= -.35840676E+03 E0= -.35841075E+03 d E =-.332051E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358408342973E+03 -0.15876E-02 -0.37846E+00 57726 0.632E+00 0.437E-01
DAV: 2 -0.358412662366E+03 -0.43194E-02 -0.66692E-02 66579 0.787E-01 0.296E-01
DAV: 3 -0.358411740767E+03 0.92160E-03 -0.26801E-03 70386 0.208E-01 0.124E-01
DAV: 4 -0.358411727346E+03 0.13420E-04 -0.84402E-04 66750 0.100E-01 0.380E-02
DAV: 5 -0.358411735026E+03 -0.76794E-05 -0.10981E-04 69378 0.368E-02 0.193E-02
DAV: 6 -0.358411734494E+03 0.53163E-06 -0.13224E-05 40659 0.162E-02
79 F= -.35841173E+03 E0= -.35841573E+03 d E =-.381843E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358428734409E+03 -0.16999E-01 -0.85638E+00 57720 0.947E+00 0.683E-01
DAV: 2 -0.358438758416E+03 -0.10024E-01 -0.15815E-01 67983 0.121E+00 0.450E-01
DAV: 3 -0.358436501362E+03 0.22571E-02 -0.62010E-03 69711 0.300E-01 0.189E-01
DAV: 4 -0.358436510792E+03 -0.94301E-05 -0.19612E-03 66867 0.145E-01 0.575E-02
DAV: 5 -0.358436521242E+03 -0.10450E-04 -0.19596E-04 68262 0.518E-02 0.240E-02
DAV: 6 -0.358436522808E+03 -0.15658E-05 -0.27716E-05 50397 0.195E-02
80 F= -.35843652E+03 E0= -.35844052E+03 d E =-.247883E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358437367455E+03 -0.84621E-03 -0.89549E-01 57774 0.306E+00 0.220E-01
DAV: 2 -0.358438393282E+03 -0.10258E-02 -0.16344E-02 67848 0.389E-01 0.145E-01
DAV: 3 -0.358438162056E+03 0.23123E-03 -0.66595E-04 69534 0.984E-02 0.583E-02
DAV: 4 -0.358438167699E+03 -0.56428E-05 -0.20168E-04 67740 0.460E-02 0.183E-02
DAV: 5 -0.358438168414E+03 -0.71508E-06 -0.17775E-05 42531 0.167E-02
81 F= -.35843817E+03 E0= -.35844217E+03 d E =-.264339E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358459003582E+03 -0.20836E-01 -0.76891E+00 57720 0.894E+00 0.650E-01
DAV: 2 -0.358467400609E+03 -0.83970E-02 -0.13680E-01 68163 0.114E+00 0.426E-01
DAV: 3 -0.358465463177E+03 0.19374E-02 -0.53181E-03 68703 0.273E-01 0.179E-01
DAV: 4 -0.358465449308E+03 0.13869E-04 -0.17880E-03 66471 0.142E-01 0.524E-02
DAV: 5 -0.358465455912E+03 -0.66037E-05 -0.21995E-04 71637 0.558E-02 0.252E-02
DAV: 6 -0.358465455200E+03 0.71217E-06 -0.28302E-05 50784 0.196E-02
82 F= -.35846546E+03 E0= -.35846946E+03 d E =-.272868E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358468227602E+03 -0.27717E-02 -0.33526E+00 57720 0.591E+00 0.428E-01
DAV: 2 -0.358471898160E+03 -0.36706E-02 -0.59847E-02 68118 0.755E-01 0.282E-01
DAV: 3 -0.358471049238E+03 0.84892E-03 -0.23514E-03 68694 0.182E-01 0.118E-01
DAV: 4 -0.358471042879E+03 0.63594E-05 -0.78386E-04 66993 0.947E-02 0.345E-02
DAV: 5 -0.358471045708E+03 -0.28297E-05 -0.97901E-05 67992 0.371E-02
83 F= -.35847105E+03 E0= -.35847506E+03 d E =-.328773E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358491406240E+03 -0.20363E-01 -0.73984E+00 57720 0.875E+00 0.642E-01
DAV: 2 -0.358499593391E+03 -0.81872E-02 -0.13114E-01 66777 0.111E+00 0.429E-01
DAV: 3 -0.358497692570E+03 0.19008E-02 -0.51840E-03 68703 0.287E-01 0.181E-01
DAV: 4 -0.358497664334E+03 0.28235E-04 -0.18261E-03 66300 0.143E-01 0.511E-02
DAV: 5 -0.358497667303E+03 -0.29684E-05 -0.24615E-04 68487 0.592E-02 0.264E-02
DAV: 6 -0.358497666013E+03 0.12894E-05 -0.30763E-05 52674 0.218E-02
84 F= -.35849767E+03 E0= -.35850168E+03 d E =-.266203E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358500365624E+03 -0.26983E-02 -0.30525E+00 57720 0.562E+00 0.411E-01
DAV: 2 -0.358503736220E+03 -0.33706E-02 -0.54408E-02 66795 0.716E-01 0.276E-01
DAV: 3 -0.358502933896E+03 0.80232E-03 -0.21674E-03 68685 0.187E-01 0.116E-01
DAV: 4 -0.358502920129E+03 0.13767E-04 -0.77914E-04 66300 0.934E-02 0.330E-02
DAV: 5 -0.358502920190E+03 -0.60796E-07 -0.10619E-04 68433 0.395E-02 0.172E-02
DAV: 6 -0.358502919428E+03 0.76199E-06 -0.13068E-05 42891 0.145E-02
85 F= -.35850292E+03 E0= -.35850693E+03 d E =-.318737E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358524751581E+03 -0.21831E-01 -0.78939E+00 57720 0.900E+00 0.661E-01
DAV: 2 -0.358533308024E+03 -0.85564E-02 -0.13659E-01 66678 0.113E+00 0.435E-01
DAV: 3 -0.358531303374E+03 0.20047E-02 -0.53370E-03 68658 0.280E-01 0.172E-01
DAV: 4 -0.358531351155E+03 -0.47781E-04 -0.17609E-03 66390 0.136E-01 0.500E-02
DAV: 5 -0.358531356426E+03 -0.52711E-05 -0.19832E-04 70386 0.501E-02 0.250E-02
DAV: 6 -0.358531356599E+03 -0.17307E-06 -0.25625E-05 45663 0.210E-02
86 F= -.35853136E+03 E0= -.35853537E+03 d E =-.284372E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358535157220E+03 -0.38008E-02 -0.84153E+00 57720 0.929E+00 0.684E-01
DAV: 2 -0.358544167079E+03 -0.90099E-02 -0.14467E-01 66642 0.116E+00 0.448E-01
DAV: 3 -0.358542043672E+03 0.21234E-02 -0.56613E-03 68640 0.289E-01 0.178E-01
DAV: 4 -0.358542100081E+03 -0.56409E-04 -0.18785E-03 66408 0.140E-01 0.519E-02
DAV: 5 -0.358542105198E+03 -0.51171E-05 -0.20761E-04 70413 0.515E-02 0.258E-02
DAV: 6 -0.358542105460E+03 -0.26251E-06 -0.27710E-05 45969 0.219E-02
87 F= -.35854211E+03 E0= -.35854612E+03 d E =-.391860E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358564028781E+03 -0.21924E-01 -0.62319E+00 57720 0.801E+00 0.589E-01
DAV: 2 -0.358570669339E+03 -0.66406E-02 -0.10612E-01 66597 0.995E-01 0.380E-01
DAV: 3 -0.358569109524E+03 0.15598E-02 -0.42926E-03 68640 0.252E-01 0.141E-01
DAV: 4 -0.358569192176E+03 -0.82652E-04 -0.14006E-03 66498 0.118E-01 0.461E-02
DAV: 5 -0.358569193573E+03 -0.13966E-05 -0.13396E-04 70764 0.431E-02 0.202E-02
DAV: 6 -0.358569193742E+03 -0.16944E-06 -0.18871E-05 42900 0.160E-02
88 F= -.35856919E+03 E0= -.35857321E+03 d E =-.270883E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358575620351E+03 -0.64268E-02 -0.14784E+01 57720 0.123E+01 0.914E-01
DAV: 2 -0.358591577456E+03 -0.15957E-01 -0.25361E-01 66651 0.154E+00 0.588E-01
DAV: 3 -0.358587852186E+03 0.37253E-02 -0.10029E-02 68640 0.385E-01 0.228E-01
DAV: 4 -0.358587998594E+03 -0.14641E-03 -0.33429E-03 66408 0.187E-01 0.723E-02
DAV: 5 -0.358588008208E+03 -0.96146E-05 -0.32806E-04 70800 0.669E-02 0.322E-02
DAV: 6 -0.358588010272E+03 -0.20633E-05 -0.51937E-05 63978 0.249E-02
89 F= -.35858801E+03 E0= -.35859203E+03 d E =-.459048E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358611189831E+03 -0.23182E-01 -0.67800E+00 57720 0.835E+00 0.616E-01
DAV: 2 -0.358618505253E+03 -0.73154E-02 -0.11762E-01 66318 0.103E+00 0.406E-01
DAV: 3 -0.358616792876E+03 0.17124E-02 -0.46167E-03 68640 0.272E-01 0.158E-01
DAV: 4 -0.358616842780E+03 -0.49904E-04 -0.16276E-03 66282 0.131E-01 0.498E-02
DAV: 5 -0.358616841417E+03 0.13627E-05 -0.17726E-04 70350 0.530E-02 0.246E-02
DAV: 6 -0.358616841550E+03 -0.13266E-06 -0.35070E-05 61899 0.215E-02
90 F= -.35861684E+03 E0= -.35862087E+03 d E =-.288313E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358622029341E+03 -0.51879E-02 -0.89322E+00 57720 0.959E+00 0.709E-01
DAV: 2 -0.358631726275E+03 -0.96969E-02 -0.15557E-01 66363 0.119E+00 0.467E-01
DAV: 3 -0.358629443368E+03 0.22829E-02 -0.61099E-03 68640 0.315E-01 0.184E-01
DAV: 4 -0.358629494395E+03 -0.51027E-04 -0.22117E-03 66246 0.154E-01 0.582E-02
DAV: 5 -0.358629494785E+03 -0.39051E-06 -0.24692E-04 69864 0.627E-02 0.288E-02
DAV: 6 -0.358629494955E+03 -0.16974E-06 -0.48523E-05 64230 0.252E-02
91 F= -.35862949E+03 E0= -.35863353E+03 d E =-.414847E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358649042202E+03 -0.19547E-01 -0.56287E+00 57720 0.762E+00 0.556E-01
DAV: 2 -0.358655115806E+03 -0.60736E-02 -0.96853E-02 66165 0.941E-01 0.365E-01
DAV: 3 -0.358653813838E+03 0.13020E-02 -0.37074E-03 68658 0.234E-01 0.142E-01
DAV: 4 -0.358653883878E+03 -0.70040E-04 -0.12166E-03 66381 0.113E-01 0.441E-02
DAV: 5 -0.358653887479E+03 -0.36009E-05 -0.11639E-04 70737 0.411E-02 0.204E-02
DAV: 6 -0.358653888183E+03 -0.70328E-06 -0.17178E-05 40659 0.151E-02
92 F= -.35865389E+03 E0= -.35865792E+03 d E =-.243932E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358657808108E+03 -0.39206E-02 -0.20986E+01 57720 0.147E+01 0.109E+00
DAV: 2 -0.358680639166E+03 -0.22831E-01 -0.36379E-01 66201 0.183E+00 0.705E-01
DAV: 3 -0.358675830435E+03 0.48087E-02 -0.13160E-02 68703 0.437E-01 0.296E-01
DAV: 4 -0.358675991545E+03 -0.16111E-03 -0.45884E-03 66345 0.221E-01 0.881E-02
DAV: 5 -0.358676012738E+03 -0.21193E-04 -0.43759E-04 70440 0.806E-02 0.393E-02
DAV: 6 -0.358676019702E+03 -0.69631E-05 -0.76880E-05 63960 0.295E-02
93 F= -.35867602E+03 E0= -.35868006E+03 d E =-.465247E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358697818084E+03 -0.21805E-01 -0.78707E+00 57720 0.906E+00 0.666E-01
DAV: 2 -0.358707225936E+03 -0.94079E-02 -0.14449E-01 66237 0.116E+00 0.434E-01
DAV: 3 -0.358705275856E+03 0.19501E-02 -0.53641E-03 68829 0.274E-01 0.180E-01
DAV: 4 -0.358705296996E+03 -0.21139E-04 -0.17261E-03 66300 0.141E-01 0.514E-02
DAV: 5 -0.358705310233E+03 -0.13237E-04 -0.18529E-04 68496 0.461E-02 0.252E-02
DAV: 6 -0.358705311002E+03 -0.76930E-06 -0.24374E-05 46815 0.183E-02
94 F= -.35870531E+03 E0= -.35870936E+03 d E =-.292913E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358708455152E+03 -0.31449E-02 -0.66761E+00 57720 0.835E+00 0.612E-01
DAV: 2 -0.358716428432E+03 -0.79733E-02 -0.12241E-01 66228 0.107E+00 0.399E-01
DAV: 3 -0.358714772107E+03 0.16563E-02 -0.45848E-03 68766 0.254E-01 0.166E-01
DAV: 4 -0.358714786630E+03 -0.14522E-04 -0.14666E-03 66345 0.131E-01 0.475E-02
DAV: 5 -0.358714797752E+03 -0.11122E-04 -0.16076E-04 68478 0.429E-02 0.235E-02
DAV: 6 -0.358714798265E+03 -0.51370E-06 -0.21138E-05 44493 0.171E-02
95 F= -.35871480E+03 E0= -.35871885E+03 d E =-.387786E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358734103006E+03 -0.19305E-01 -0.96799E+00 57720 0.999E+00 0.740E-01
DAV: 2 -0.358745147811E+03 -0.11045E-01 -0.17230E-01 66318 0.126E+00 0.477E-01
DAV: 3 -0.358742939218E+03 0.22086E-02 -0.65960E-03 68694 0.304E-01 0.197E-01
DAV: 4 -0.358742976820E+03 -0.37602E-04 -0.19056E-03 66138 0.146E-01 0.596E-02
DAV: 5 -0.358743000339E+03 -0.23518E-04 -0.23658E-04 68019 0.511E-02 0.282E-02
DAV: 6 -0.358742999435E+03 0.90350E-06 -0.28752E-05 53907 0.225E-02
96 F= -.35874300E+03 E0= -.35874706E+03 d E =-.282012E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358744050632E+03 -0.10503E-02 -0.11527E+01 57720 0.109E+01 0.808E-01
DAV: 2 -0.358757284194E+03 -0.13234E-01 -0.20584E-01 66345 0.138E+00 0.522E-01
DAV: 3 -0.358754640745E+03 0.26434E-02 -0.78794E-03 68757 0.335E-01 0.219E-01
DAV: 4 -0.358754675121E+03 -0.34376E-04 -0.23295E-03 66120 0.161E-01 0.664E-02
DAV: 5 -0.358754704563E+03 -0.29442E-04 -0.29595E-04 67821 0.581E-02 0.313E-02
DAV: 6 -0.358754703389E+03 0.11733E-05 -0.35613E-05 56517 0.251E-02
97 F= -.35875470E+03 E0= -.35875877E+03 d E =-.399051E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358775103936E+03 -0.20399E-01 -0.88981E+00 57720 0.960E+00 0.701E-01
DAV: 2 -0.358785734810E+03 -0.10631E-01 -0.16146E-01 66102 0.121E+00 0.454E-01
DAV: 3 -0.358783756411E+03 0.19784E-02 -0.54671E-03 68667 0.276E-01 0.187E-01
DAV: 4 -0.358783838972E+03 -0.82561E-04 -0.18213E-03 66039 0.141E-01 0.560E-02
DAV: 5 -0.358783853373E+03 -0.14401E-04 -0.19576E-04 67947 0.489E-02 0.252E-02
DAV: 6 -0.358783854673E+03 -0.12994E-05 -0.22161E-05 47229 0.193E-02
98 F= -.35878385E+03 E0= -.35878792E+03 d E =-.291513E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358784199280E+03 -0.34591E-03 -0.16249E+01 57720 0.130E+01 0.953E-01
DAV: 2 -0.358803724178E+03 -0.19525E-01 -0.29618E-01 66192 0.164E+00 0.613E-01
DAV: 3 -0.358800148590E+03 0.35756E-02 -0.98122E-03 68730 0.369E-01 0.263E-01
DAV: 4 -0.358800247767E+03 -0.99177E-04 -0.33459E-03 66102 0.192E-01 0.779E-02
DAV: 5 -0.358800279879E+03 -0.32112E-04 -0.37005E-04 67389 0.674E-02 0.346E-02
DAV: 6 -0.358800283442E+03 -0.35637E-05 -0.46547E-05 63969 0.268E-02
99 F= -.35880028E+03 E0= -.35880435E+03 d E =-.455801E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358820311514E+03 -0.20032E-01 -0.11856E+01 57720 0.111E+01 0.799E-01
DAV: 2 -0.358834747781E+03 -0.14436E-01 -0.21585E-01 65931 0.139E+00 0.521E-01
DAV: 3 -0.358832067667E+03 0.26801E-02 -0.70821E-03 68757 0.314E-01 0.215E-01
DAV: 4 -0.358832160715E+03 -0.93048E-04 -0.24749E-03 66021 0.164E-01 0.612E-02
DAV: 5 -0.358832171092E+03 -0.10377E-04 -0.25346E-04 68055 0.580E-02 0.284E-02
DAV: 6 -0.358832174943E+03 -0.38508E-05 -0.38769E-05 63402 0.208E-02
100 F= -.35883217E+03 E0= -.35883625E+03 d E =-.318915E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358832575862E+03 -0.40477E-03 -0.94206E+00 57720 0.985E+00 0.710E-01
DAV: 2 -0.358843991801E+03 -0.11416E-01 -0.17086E-01 65895 0.124E+00 0.464E-01
DAV: 3 -0.358841869619E+03 0.21222E-02 -0.56742E-03 68730 0.282E-01 0.191E-01
DAV: 4 -0.358841944145E+03 -0.74526E-04 -0.19626E-03 65958 0.147E-01 0.547E-02
DAV: 5 -0.358841952678E+03 -0.85324E-05 -0.20358E-04 68190 0.517E-02 0.261E-02
DAV: 6 -0.358841955571E+03 -0.28932E-05 -0.31970E-05 59631 0.193E-02
101 F= -.35884196E+03 E0= -.35884604E+03 d E =-.416721E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358860490489E+03 -0.18538E-01 -0.16783E+01 57720 0.131E+01 0.949E-01
DAV: 2 -0.358880474925E+03 -0.19984E-01 -0.29744E-01 65769 0.163E+00 0.613E-01
DAV: 3 -0.358876845532E+03 0.36294E-02 -0.93477E-03 69018 0.373E-01 0.260E-01
DAV: 4 -0.358876936845E+03 -0.91313E-04 -0.34699E-03 65589 0.188E-01 0.715E-02
DAV: 5 -0.358876950619E+03 -0.13774E-04 -0.39129E-04 67875 0.771E-02 0.326E-02
DAV: 6 -0.358876952466E+03 -0.18470E-05 -0.52098E-05 64077 0.258E-02
102 F= -.35887695E+03 E0= -.35888104E+03 d E =-.349969E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358872759144E+03 0.41915E-02 -0.18874E+01 57720 0.139E+01 0.101E+00
DAV: 2 -0.358895309689E+03 -0.22551E-01 -0.33536E-01 65715 0.174E+00 0.653E-01
DAV: 3 -0.358891204616E+03 0.41051E-02 -0.10558E-02 69171 0.399E-01 0.279E-01
DAV: 4 -0.358891289056E+03 -0.84440E-04 -0.39949E-03 65904 0.203E-01 0.771E-02
DAV: 5 -0.358891305721E+03 -0.16665E-04 -0.45667E-04 68442 0.849E-02 0.351E-02
DAV: 6 -0.358891307745E+03 -0.20235E-05 -0.63833E-05 64770 0.285E-02
103 F= -.35889131E+03 E0= -.35889540E+03 d E =-.493522E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358912116600E+03 -0.20811E-01 -0.13505E+01 57720 0.118E+01 0.845E-01
DAV: 2 -0.358928782234E+03 -0.16666E-01 -0.24463E-01 65679 0.148E+00 0.550E-01
DAV: 3 -0.358925925455E+03 0.28568E-02 -0.72607E-03 69108 0.329E-01 0.238E-01
DAV: 4 -0.358926020454E+03 -0.94998E-04 -0.29055E-03 65859 0.175E-01 0.647E-02
DAV: 5 -0.358926033079E+03 -0.12626E-04 -0.29568E-04 68379 0.658E-02 0.299E-02
DAV: 6 -0.358926035492E+03 -0.24125E-05 -0.43477E-05 63996 0.232E-02
104 F= -.35892604E+03 E0= -.35893013E+03 d E =-.347277E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358917828246E+03 0.82048E-02 -0.29338E+01 57720 0.174E+01 0.127E+00
DAV: 2 -0.358954788434E+03 -0.36960E-01 -0.54032E-01 65832 0.219E+00 0.813E-01
DAV: 3 -0.358948673564E+03 0.61149E-02 -0.15469E-02 69540 0.479E-01 0.374E-01
DAV: 4 -0.358948730074E+03 -0.56511E-04 -0.64842E-03 66111 0.265E-01 0.100E-01
DAV: 5 -0.358948770828E+03 -0.40754E-04 -0.68905E-04 67488 0.102E-01 0.449E-02
DAV: 6 -0.358948777851E+03 -0.70224E-05 -0.10126E-04 66714 0.353E-02 0.195E-02
DAV: 7 -0.358948776323E+03 0.15278E-05 -0.15847E-05 44007 0.169E-02
105 F= -.35894878E+03 E0= -.35895287E+03 d E =-.574686E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358966618576E+03 -0.17841E-01 -0.19370E+01 57720 0.142E+01 0.101E+00
DAV: 2 -0.358992072596E+03 -0.25454E-01 -0.36219E-01 65841 0.180E+00 0.648E-01
DAV: 3 -0.358988017502E+03 0.40551E-02 -0.10477E-02 68910 0.380E-01 0.286E-01
DAV: 4 -0.358988074904E+03 -0.57402E-04 -0.39950E-03 66174 0.214E-01 0.757E-02
DAV: 5 -0.358988104473E+03 -0.29570E-04 -0.43393E-04 67272 0.752E-02 0.324E-02
DAV: 6 -0.358988108157E+03 -0.36836E-05 -0.56922E-05 64005 0.252E-02
106 F= -.35898811E+03 E0= -.35899220E+03 d E =-.393318E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.358978433113E+03 0.96714E-02 -0.22878E+01 57720 0.154E+01 0.110E+00
DAV: 2 -0.359008509395E+03 -0.30076E-01 -0.42768E-01 65832 0.196E+00 0.705E-01
DAV: 3 -0.359003734610E+03 0.47748E-02 -0.12398E-02 68910 0.413E-01 0.314E-01
DAV: 4 -0.359003776402E+03 -0.41791E-04 -0.47008E-03 66282 0.233E-01 0.838E-02
DAV: 5 -0.359003813191E+03 -0.36789E-04 -0.52129E-04 67497 0.824E-02 0.360E-02
DAV: 6 -0.359003817523E+03 -0.43321E-05 -0.68333E-05 64221 0.279E-02
107 F= -.35900382E+03 E0= -.35900791E+03 d E =-.550412E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359013172060E+03 -0.93589E-02 -0.25173E+01 57720 0.161E+01 0.113E+00
DAV: 2 -0.359045313451E+03 -0.32141E-01 -0.45982E-01 65895 0.202E+00 0.738E-01
DAV: 3 -0.359040099532E+03 0.52139E-02 -0.12945E-02 69315 0.440E-01 0.332E-01
DAV: 4 -0.359040087252E+03 0.12280E-04 -0.53225E-03 66156 0.246E-01 0.860E-02
DAV: 5 -0.359040133989E+03 -0.46737E-04 -0.67919E-04 67776 0.953E-02 0.421E-02
DAV: 6 -0.359040135765E+03 -0.17762E-05 -0.75786E-05 66057 0.337E-02
108 F= -.35904014E+03 E0= -.35904423E+03 d E =-.363182E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359032041663E+03 0.80923E-02 -0.18103E+01 57720 0.136E+01 0.954E-01
DAV: 2 -0.359055038406E+03 -0.22997E-01 -0.32937E-01 65877 0.172E+00 0.625E-01
DAV: 3 -0.359051269611E+03 0.37688E-02 -0.93234E-03 69153 0.376E-01 0.277E-01
DAV: 4 -0.359051284256E+03 -0.14645E-04 -0.38568E-03 66093 0.209E-01 0.727E-02
DAV: 5 -0.359051312614E+03 -0.28357E-04 -0.48851E-04 67974 0.822E-02 0.356E-02
DAV: 6 -0.359051313481E+03 -0.86739E-06 -0.55454E-05 64635 0.288E-02
109 F= -.35905131E+03 E0= -.35905541E+03 d E =-.474960E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359058378520E+03 -0.70659E-02 -0.20138E+01 57720 0.144E+01 0.102E+00
DAV: 2 -0.359085424505E+03 -0.27046E-01 -0.38615E-01 65715 0.185E+00 0.667E-01
DAV: 3 -0.359081123857E+03 0.43006E-02 -0.11217E-02 69378 0.406E-01 0.314E-01
DAV: 4 -0.359081015796E+03 0.10806E-03 -0.43910E-03 66318 0.226E-01 0.839E-02
DAV: 5 -0.359081065476E+03 -0.49680E-04 -0.54044E-04 66957 0.818E-02 0.379E-02
DAV: 6 -0.359081067801E+03 -0.23250E-05 -0.58905E-05 64230 0.288E-02
110 F= -.35908107E+03 E0= -.35908516E+03 d E =-.297543E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359080846814E+03 0.21866E-03 -0.19622E+00 57738 0.450E+00 0.314E-01
DAV: 2 -0.359083429473E+03 -0.25827E-02 -0.36915E-02 65679 0.571E-01 0.207E-01
DAV: 3 -0.359083021013E+03 0.40846E-03 -0.11315E-03 69024 0.130E-01 0.914E-02
DAV: 4 -0.359083024043E+03 -0.30301E-05 -0.40663E-04 66471 0.687E-02 0.251E-02
DAV: 5 -0.359083028573E+03 -0.45297E-05 -0.48724E-05 67308 0.240E-02
111 F= -.35908303E+03 E0= -.35908712E+03 d E =-.317151E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359090865274E+03 -0.78412E-02 -0.17246E+01 57720 0.133E+01 0.922E-01
DAV: 2 -0.359113965676E+03 -0.23100E-01 -0.32463E-01 65553 0.169E+00 0.600E-01
DAV: 3 -0.359110464055E+03 0.35016E-02 -0.92681E-03 69567 0.356E-01 0.272E-01
DAV: 4 -0.359110426167E+03 0.37888E-04 -0.33060E-03 66471 0.193E-01 0.727E-02
DAV: 5 -0.359110458373E+03 -0.32205E-04 -0.37073E-04 66750 0.665E-02 0.310E-02
DAV: 6 -0.359110461232E+03 -0.28593E-05 -0.39351E-05 62385 0.219E-02
112 F= -.35911046E+03 E0= -.35911456E+03 d E =-.274327E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359108495739E+03 0.19626E-02 -0.62616E+00 57720 0.803E+00 0.551E-01
DAV: 2 -0.359116713367E+03 -0.82176E-02 -0.11629E-01 65499 0.101E+00 0.361E-01
DAV: 3 -0.359115429416E+03 0.12840E-02 -0.34212E-03 69315 0.216E-01 0.157E-01
DAV: 4 -0.359115438415E+03 -0.89988E-05 -0.11831E-03 66579 0.114E-01 0.427E-02
DAV: 5 -0.359115448247E+03 -0.98317E-05 -0.12609E-04 66921 0.385E-02 0.183E-02
DAV: 6 -0.359115448882E+03 -0.63474E-06 -0.11945E-05 40758 0.128E-02
113 F= -.35911545E+03 E0= -.35911955E+03 d E =-.324203E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359121640377E+03 -0.61921E-02 -0.19986E+01 57720 0.143E+01 0.979E-01
DAV: 2 -0.359148686605E+03 -0.27046E-01 -0.37195E-01 65130 0.180E+00 0.650E-01
DAV: 3 -0.359144591481E+03 0.40951E-02 -0.10167E-02 69711 0.394E-01 0.304E-01
DAV: 4 -0.359144422734E+03 0.16875E-03 -0.42118E-03 66444 0.220E-01 0.795E-02
DAV: 5 -0.359144463961E+03 -0.41227E-04 -0.57134E-04 66957 0.850E-02 0.395E-02
DAV: 6 -0.359144465647E+03 -0.16860E-05 -0.59667E-05 65706 0.284E-02
114 F= -.35914447E+03 E0= -.35914856E+03 d E =-.290168E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359142773435E+03 0.16905E-02 -0.48543E+00 57720 0.707E+00 0.477E-01
DAV: 2 -0.359149305034E+03 -0.65316E-02 -0.89903E-02 64878 0.886E-01 0.320E-01
DAV: 3 -0.359148305413E+03 0.99962E-03 -0.24863E-03 69468 0.196E-01 0.144E-01
DAV: 4 -0.359148288311E+03 0.17103E-04 -0.10252E-03 66651 0.108E-01 0.383E-02
DAV: 5 -0.359148295214E+03 -0.69033E-05 -0.13434E-04 67317 0.418E-02 0.194E-02
DAV: 6 -0.359148295180E+03 0.33444E-07 -0.12859E-05 40587 0.140E-02
115 F= -.35914830E+03 E0= -.35915239E+03 d E =-.328463E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359154181279E+03 -0.58861E-02 -0.16378E+01 57720 0.130E+01 0.887E-01
DAV: 2 -0.359177476973E+03 -0.23296E-01 -0.31594E-01 64905 0.166E+00 0.583E-01
DAV: 3 -0.359174355012E+03 0.31220E-02 -0.76009E-03 69324 0.336E-01 0.290E-01
DAV: 4 -0.359174204956E+03 0.15006E-03 -0.35961E-03 66750 0.205E-01 0.705E-02
DAV: 5 -0.359174230786E+03 -0.25829E-04 -0.49565E-04 66282 0.820E-02 0.321E-02
DAV: 6 -0.359174234508E+03 -0.37220E-05 -0.50100E-05 64770 0.259E-02
116 F= -.35917423E+03 E0= -.35917832E+03 d E =-.259393E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359171264545E+03 0.29662E-02 -0.69494E+00 57720 0.849E+00 0.574E-01
DAV: 2 -0.359181052578E+03 -0.97880E-02 -0.13259E-01 64815 0.108E+00 0.378E-01
DAV: 3 -0.359179737217E+03 0.13154E-02 -0.32354E-03 69126 0.220E-01 0.183E-01
DAV: 4 -0.359179696266E+03 0.40951E-04 -0.14972E-03 66777 0.131E-01 0.450E-02
DAV: 5 -0.359179705167E+03 -0.89012E-05 -0.20354E-04 66669 0.525E-02 0.207E-02
DAV: 6 -0.359179706503E+03 -0.13360E-05 -0.19058E-05 45150 0.168E-02
117 F= -.35917971E+03 E0= -.35918379E+03 d E =-.314113E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359187978027E+03 -0.82729E-02 -0.11929E+01 57720 0.111E+01 0.746E-01
DAV: 2 -0.359205437858E+03 -0.17460E-01 -0.23306E-01 64545 0.142E+00 0.488E-01
DAV: 3 -0.359203235841E+03 0.22020E-02 -0.58265E-03 68856 0.282E-01 0.234E-01
DAV: 4 -0.359203148042E+03 0.87799E-04 -0.23818E-03 66714 0.170E-01 0.577E-02
DAV: 5 -0.359203172561E+03 -0.24519E-04 -0.32965E-04 66462 0.629E-02 0.274E-02
DAV: 6 -0.359203173233E+03 -0.67185E-06 -0.33475E-05 59676 0.214E-02
118 F= -.35920317E+03 E0= -.35920725E+03 d E =-.234667E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359199990632E+03 0.31819E-02 -0.73551E+00 57720 0.872E+00 0.584E-01
DAV: 2 -0.359210664338E+03 -0.10674E-01 -0.14262E-01 64527 0.111E+00 0.382E-01
DAV: 3 -0.359209312634E+03 0.13517E-02 -0.35846E-03 68811 0.221E-01 0.181E-01
DAV: 4 -0.359209270098E+03 0.42536E-04 -0.14523E-03 66840 0.132E-01 0.450E-02
DAV: 5 -0.359209284662E+03 -0.14565E-04 -0.19891E-04 66444 0.487E-02 0.214E-02
DAV: 6 -0.359209284914E+03 -0.25183E-06 -0.18761E-05 47922 0.166E-02
119 F= -.35920928E+03 E0= -.35921336E+03 d E =-.295784E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359214870801E+03 -0.55861E-02 -0.13825E+01 57720 0.120E+01 0.793E-01
DAV: 2 -0.359235435909E+03 -0.20565E-01 -0.27010E-01 64410 0.152E+00 0.519E-01
DAV: 3 -0.359232946568E+03 0.24893E-02 -0.65185E-03 68901 0.310E-01 0.252E-01
DAV: 4 -0.359232792403E+03 0.15417E-03 -0.26837E-03 66507 0.185E-01 0.617E-02
DAV: 5 -0.359232833931E+03 -0.41528E-04 -0.41986E-04 67344 0.706E-02 0.315E-02
DAV: 6 -0.359232832944E+03 0.98656E-06 -0.45388E-05 65445 0.252E-02
120 F= -.35923283E+03 E0= -.35923691E+03 d E =-.235480E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359225446762E+03 0.73872E-02 -0.11287E+01 57720 0.108E+01 0.716E-01
DAV: 2 -0.359242279715E+03 -0.16833E-01 -0.22110E-01 64302 0.138E+00 0.470E-01
DAV: 3 -0.359240237665E+03 0.20420E-02 -0.53600E-03 68865 0.282E-01 0.228E-01
DAV: 4 -0.359240120507E+03 0.11716E-03 -0.22250E-03 66723 0.169E-01 0.560E-02
DAV: 5 -0.359240154812E+03 -0.34305E-04 -0.34857E-04 67245 0.648E-02 0.287E-02
DAV: 6 -0.359240153768E+03 0.10441E-05 -0.35880E-05 60450 0.228E-02
121 F= -.35924015E+03 E0= -.35924423E+03 d E =-.308689E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359242244156E+03 -0.20893E-02 -0.15583E+01 57720 0.128E+01 0.843E-01
DAV: 2 -0.359266040951E+03 -0.23797E-01 -0.31142E-01 64293 0.163E+00 0.552E-01
DAV: 3 -0.359263310776E+03 0.27302E-02 -0.68231E-03 69000 0.323E-01 0.284E-01
DAV: 4 -0.359263112716E+03 0.19806E-03 -0.33529E-03 66777 0.210E-01 0.663E-02
DAV: 5 -0.359263155089E+03 -0.42373E-04 -0.49637E-04 66264 0.792E-02 0.328E-02
DAV: 6 -0.359263157571E+03 -0.24827E-05 -0.66012E-05 65544 0.281E-02
122 F= -.35926316E+03 E0= -.35926723E+03 d E =-.230038E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359256939258E+03 0.62158E-02 -0.85049E+00 57720 0.943E+00 0.621E-01
DAV: 2 -0.359269800557E+03 -0.12861E-01 -0.16879E-01 64293 0.120E+00 0.407E-01
DAV: 3 -0.359268317500E+03 0.14831E-02 -0.37405E-03 68928 0.240E-01 0.206E-01
DAV: 4 -0.359268231146E+03 0.86354E-04 -0.18078E-03 66957 0.154E-01 0.486E-02
DAV: 5 -0.359268254057E+03 -0.22911E-04 -0.26453E-04 66273 0.575E-02 0.244E-02
DAV: 6 -0.359268255139E+03 -0.10819E-05 -0.33597E-05 59100 0.206E-02
123 F= -.35926826E+03 E0= -.35927233E+03 d E =-.281014E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359266798986E+03 0.14551E-02 -0.17562E+01 57720 0.136E+01 0.885E-01
DAV: 2 -0.359294979858E+03 -0.28181E-01 -0.35909E-01 64176 0.174E+00 0.580E-01
DAV: 3 -0.359292017418E+03 0.29624E-02 -0.72651E-03 68802 0.333E-01 0.300E-01
DAV: 4 -0.359291839899E+03 0.17752E-03 -0.40656E-03 66939 0.232E-01 0.708E-02
DAV: 5 -0.359291867786E+03 -0.27887E-04 -0.63888E-04 66174 0.945E-02 0.360E-02
DAV: 6 -0.359291872550E+03 -0.47643E-05 -0.10427E-04 65373 0.337E-02 0.185E-02
DAV: 7 -0.359291869520E+03 0.30301E-05 -0.12032E-05 45843 0.170E-02
124 F= -.35929187E+03 E0= -.35929593E+03 d E =-.236144E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359274532454E+03 0.17340E-01 -0.17793E+01 57720 0.136E+01 0.890E-01
DAV: 2 -0.359302878139E+03 -0.28346E-01 -0.36217E-01 64203 0.175E+00 0.583E-01
DAV: 3 -0.359299890955E+03 0.29872E-02 -0.73696E-03 68811 0.335E-01 0.302E-01
DAV: 4 -0.359299710480E+03 0.18047E-03 -0.41039E-03 66894 0.233E-01 0.716E-02
DAV: 5 -0.359299739242E+03 -0.28762E-04 -0.64146E-04 66318 0.950E-02 0.363E-02
DAV: 6 -0.359299744313E+03 -0.50715E-05 -0.10862E-04 65292 0.343E-02 0.187E-02
DAV: 7 -0.359299741092E+03 0.32209E-05 -0.12771E-05 46464 0.176E-02
125 F= -.35929974E+03 E0= -.35930380E+03 d E =-.314860E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359301643939E+03 -0.18996E-02 -0.13622E+01 57720 0.119E+01 0.778E-01
DAV: 2 -0.359323522123E+03 -0.21878E-01 -0.27852E-01 63807 0.153E+00 0.512E-01
DAV: 3 -0.359321225826E+03 0.22963E-02 -0.54977E-03 68739 0.300E-01 0.269E-01
DAV: 4 -0.359321060452E+03 0.16537E-03 -0.33607E-03 66966 0.210E-01 0.630E-02
DAV: 5 -0.359321081245E+03 -0.20793E-04 -0.54747E-04 66273 0.900E-02 0.331E-02
DAV: 6 -0.359321083850E+03 -0.26053E-05 -0.81830E-05 65337 0.299E-02
126 F= -.35932108E+03 E0= -.35932513E+03 d E =-.213428E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359299504869E+03 0.21576E-01 -0.21659E+01 57720 0.150E+01 0.986E-01
DAV: 2 -0.359334826805E+03 -0.35322E-01 -0.44745E-01 63816 0.195E+00 0.648E-01
DAV: 3 -0.359331179936E+03 0.36469E-02 -0.89106E-03 68694 0.381E-01 0.345E-01
DAV: 4 -0.359330877986E+03 0.30195E-03 -0.54618E-03 67173 0.268E-01 0.811E-02
DAV: 5 -0.359330915660E+03 -0.37674E-04 -0.88898E-04 66228 0.116E-01 0.423E-02
DAV: 6 -0.359330920660E+03 -0.49996E-05 -0.13473E-04 65391 0.384E-02 0.224E-02
DAV: 7 -0.359330917177E+03 0.34833E-05 -0.17528E-05 48381 0.191E-02
127 F= -.35933092E+03 E0= -.35933496E+03 d E =-.311761E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359334111030E+03 -0.31904E-02 -0.10754E+01 57720 0.106E+01 0.696E-01
DAV: 2 -0.359351169760E+03 -0.17059E-01 -0.22194E-01 63960 0.138E+00 0.456E-01
DAV: 3 -0.359349357762E+03 0.18120E-02 -0.46361E-03 69486 0.268E-01 0.246E-01
DAV: 4 -0.359349217157E+03 0.14061E-03 -0.26000E-03 67029 0.186E-01 0.601E-02
DAV: 5 -0.359349242577E+03 -0.25421E-04 -0.41119E-04 66525 0.785E-02 0.278E-02
DAV: 6 -0.359349244813E+03 -0.22359E-05 -0.54733E-05 65175 0.250E-02
128 F= -.35934924E+03 E0= -.35935329E+03 d E =-.183276E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359343234998E+03 0.60076E-02 -0.83309E+00 57720 0.933E+00 0.613E-01
DAV: 2 -0.359356461689E+03 -0.13227E-01 -0.17173E-01 63942 0.121E+00 0.401E-01
DAV: 3 -0.359355079777E+03 0.13819E-02 -0.35923E-03 69423 0.236E-01 0.216E-01
DAV: 4 -0.359354979783E+03 0.99994E-04 -0.19876E-03 67182 0.162E-01 0.526E-02
DAV: 5 -0.359354999762E+03 -0.19980E-04 -0.31272E-04 66453 0.681E-02 0.245E-02
DAV: 6 -0.359355001308E+03 -0.15451E-05 -0.40371E-05 63717 0.216E-02
129 F= -.35935500E+03 E0= -.35935905E+03 d E =-.240841E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359357544995E+03 -0.25452E-02 -0.10508E+01 57720 0.105E+01 0.682E-01
DAV: 2 -0.359374894811E+03 -0.17350E-01 -0.22070E-01 63996 0.136E+00 0.450E-01
DAV: 3 -0.359373127412E+03 0.17674E-02 -0.47651E-03 69909 0.265E-01 0.239E-01
DAV: 4 -0.359372967849E+03 0.15956E-03 -0.24157E-03 67209 0.186E-01 0.589E-02
DAV: 5 -0.359373000979E+03 -0.33130E-04 -0.40420E-04 66282 0.723E-02 0.300E-02
DAV: 6 -0.359373002573E+03 -0.15943E-05 -0.67705E-05 65580 0.277E-02
130 F= -.35937300E+03 E0= -.35937704E+03 d E =-.180013E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359368692895E+03 0.43081E-02 -0.59141E+00 57720 0.786E+00 0.511E-01
DAV: 2 -0.359378329426E+03 -0.96365E-02 -0.12288E-01 64059 0.102E+00 0.338E-01
DAV: 3 -0.359377348089E+03 0.98134E-03 -0.26709E-03 69954 0.199E-01 0.178E-01
DAV: 4 -0.359377267471E+03 0.80618E-04 -0.13438E-03 67488 0.138E-01 0.439E-02
DAV: 5 -0.359377285410E+03 -0.17939E-04 -0.22344E-04 65886 0.538E-02 0.225E-02
DAV: 6 -0.359377286126E+03 -0.71596E-06 -0.36715E-05 61503 0.206E-02
131 F= -.35937729E+03 E0= -.35938132E+03 d E =-.222848E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359374681829E+03 0.26036E-02 -0.13644E+01 57720 0.119E+01 0.777E-01
DAV: 2 -0.359396990515E+03 -0.22309E-01 -0.28449E-01 64041 0.154E+00 0.517E-01
DAV: 3 -0.359394688192E+03 0.23023E-02 -0.57102E-03 69162 0.306E-01 0.280E-01
DAV: 4 -0.359394451946E+03 0.23625E-03 -0.34880E-03 67371 0.218E-01 0.675E-02
DAV: 5 -0.359394484481E+03 -0.32535E-04 -0.59851E-04 66210 0.932E-02 0.346E-02
DAV: 6 -0.359394486977E+03 -0.24961E-05 -0.88801E-05 65526 0.315E-02
132 F= -.35939449E+03 E0= -.35939851E+03 d E =-.172009E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359392529502E+03 0.19550E-02 -0.27159E+00 57720 0.532E+00 0.346E-01
DAV: 2 -0.359396959084E+03 -0.44296E-02 -0.56494E-02 64032 0.688E-01 0.231E-01
DAV: 3 -0.359396512383E+03 0.44670E-03 -0.11308E-03 69153 0.136E-01 0.123E-01
DAV: 4 -0.359396473169E+03 0.39214E-04 -0.67901E-04 68199 0.959E-02 0.294E-02
DAV: 5 -0.359396479431E+03 -0.62617E-05 -0.11591E-04 65193 0.408E-02 0.155E-02
DAV: 6 -0.359396479597E+03 -0.16660E-06 -0.15579E-05 44187 0.138E-02
133 F= -.35939648E+03 E0= -.35940050E+03 d E =-.191935E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359396035903E+03 0.44353E-03 -0.12277E+01 57720 0.113E+01 0.734E-01
DAV: 2 -0.359416241556E+03 -0.20206E-01 -0.25634E-01 63987 0.146E+00 0.491E-01
DAV: 3 -0.359414189546E+03 0.20520E-02 -0.49923E-03 68946 0.289E-01 0.269E-01
DAV: 4 -0.359413986546E+03 0.20300E-03 -0.30770E-03 67875 0.204E-01 0.640E-02
DAV: 5 -0.359414019452E+03 -0.32906E-04 -0.50795E-04 65400 0.856E-02 0.311E-02
DAV: 6 -0.359414022476E+03 -0.30238E-05 -0.65468E-05 65832 0.270E-02
134 F= -.35941402E+03 E0= -.35941804E+03 d E =-.175429E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359409579813E+03 0.44396E-02 -0.57660E+00 57720 0.775E+00 0.502E-01
DAV: 2 -0.359419018034E+03 -0.94382E-02 -0.11976E-01 64014 0.999E-01 0.336E-01
DAV: 3 -0.359418074087E+03 0.94395E-03 -0.23340E-03 68964 0.198E-01 0.182E-01
DAV: 4 -0.359417989461E+03 0.84626E-04 -0.14174E-03 68199 0.138E-01 0.431E-02
DAV: 5 -0.359418005046E+03 -0.15585E-04 -0.23336E-04 64905 0.576E-02 0.213E-02
DAV: 6 -0.359418006113E+03 -0.10667E-05 -0.28114E-05 53376 0.182E-02
135 F= -.35941801E+03 E0= -.35942203E+03 d E =-.215265E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359420295537E+03 -0.22905E-02 -0.98874E+00 57720 0.101E+01 0.650E-01
DAV: 2 -0.359436504762E+03 -0.16209E-01 -0.20395E-01 64077 0.130E+00 0.434E-01
DAV: 3 -0.359434873101E+03 0.16317E-02 -0.41145E-03 69225 0.254E-01 0.232E-01
DAV: 4 -0.359434740824E+03 0.13228E-03 -0.23333E-03 67974 0.178E-01 0.563E-02
DAV: 5 -0.359434762434E+03 -0.21610E-04 -0.35935E-04 65283 0.735E-02 0.268E-02
DAV: 6 -0.359434765364E+03 -0.29307E-05 -0.55009E-05 66300 0.244E-02
136 F= -.35943477E+03 E0= -.35943878E+03 d E =-.167593E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359427764977E+03 0.69975E-02 -0.90447E+00 57720 0.969E+00 0.622E-01
DAV: 2 -0.359442482818E+03 -0.14718E-01 -0.18542E-01 64086 0.124E+00 0.415E-01
DAV: 3 -0.359440996375E+03 0.14864E-02 -0.37801E-03 69189 0.243E-01 0.221E-01
DAV: 4 -0.359440882339E+03 0.11404E-03 -0.21170E-03 68145 0.170E-01 0.540E-02
DAV: 5 -0.359440901510E+03 -0.19171E-04 -0.32520E-04 65076 0.701E-02 0.257E-02
DAV: 6 -0.359440904174E+03 -0.26633E-05 -0.50729E-05 66309 0.234E-02
137 F= -.35944090E+03 E0= -.35944492E+03 d E =-.228981E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359441475826E+03 -0.57432E-03 -0.10745E+01 57720 0.106E+01 0.688E-01
DAV: 2 -0.359459101614E+03 -0.17626E-01 -0.22269E-01 64581 0.136E+00 0.459E-01
DAV: 3 -0.359457294342E+03 0.18073E-02 -0.42203E-03 69180 0.270E-01 0.254E-01
DAV: 4 -0.359457098002E+03 0.19634E-03 -0.30121E-03 68199 0.200E-01 0.615E-02
DAV: 5 -0.359457112173E+03 -0.14171E-04 -0.50492E-04 65436 0.901E-02 0.301E-02
DAV: 6 -0.359457116107E+03 -0.39334E-05 -0.79486E-05 65868 0.291E-02
138 F= -.35945712E+03 E0= -.35946112E+03 d E =-.162119E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359453167548E+03 0.39446E-02 -0.53098E+00 57720 0.744E+00 0.484E-01
DAV: 2 -0.359461895596E+03 -0.87280E-02 -0.11028E-01 64554 0.957E-01 0.323E-01
DAV: 3 -0.359461008573E+03 0.88702E-03 -0.20898E-03 69216 0.190E-01 0.178E-01
DAV: 4 -0.359460920765E+03 0.87808E-04 -0.14771E-03 68343 0.140E-01 0.430E-02
DAV: 5 -0.359460927765E+03 -0.70000E-05 -0.24607E-04 65247 0.628E-02 0.213E-02
DAV: 6 -0.359460929579E+03 -0.18136E-05 -0.38945E-05 63870 0.203E-02
139 F= -.35946093E+03 E0= -.35946493E+03 d E =-.200254E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359457853623E+03 0.30741E-02 -0.12396E+01 57720 0.114E+01 0.739E-01
DAV: 2 -0.359478108026E+03 -0.20254E-01 -0.25871E-01 64185 0.147E+00 0.498E-01
DAV: 3 -0.359475980281E+03 0.21277E-02 -0.51304E-03 69396 0.302E-01 0.274E-01
DAV: 4 -0.359475750363E+03 0.22992E-03 -0.34274E-03 68280 0.215E-01 0.666E-02
DAV: 5 -0.359475776068E+03 -0.25706E-04 -0.53379E-04 64797 0.899E-02 0.326E-02
DAV: 6 -0.359475780416E+03 -0.43480E-05 -0.91469E-05 66444 0.311E-02
140 F= -.35947578E+03 E0= -.35947978E+03 d E =-.148508E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359474142625E+03 0.16334E-02 -0.23254E+00 57726 0.493E+00 0.319E-01
DAV: 2 -0.359477887025E+03 -0.37444E-02 -0.47965E-02 64194 0.634E-01 0.216E-01
DAV: 3 -0.359477496465E+03 0.39056E-03 -0.96104E-04 69495 0.131E-01 0.117E-01
DAV: 4 -0.359477462192E+03 0.34273E-04 -0.62442E-04 68568 0.915E-02 0.283E-02
DAV: 5 -0.359477467262E+03 -0.50697E-05 -0.97284E-05 64320 0.379E-02
141 F= -.35947747E+03 E0= -.35948147E+03 d E =-.165377E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359474078729E+03 0.33835E-02 -0.10672E+01 57720 0.106E+01 0.686E-01
DAV: 2 -0.359491500957E+03 -0.17422E-01 -0.22172E-01 64248 0.137E+00 0.449E-01
DAV: 3 -0.359489747704E+03 0.17533E-02 -0.45434E-03 70422 0.269E-01 0.242E-01
DAV: 4 -0.359489588133E+03 0.15957E-03 -0.25938E-03 68541 0.190E-01 0.599E-02
DAV: 5 -0.359489611288E+03 -0.23155E-04 -0.42194E-04 65058 0.793E-02 0.293E-02
DAV: 6 -0.359489614386E+03 -0.30977E-05 -0.74079E-05 66021 0.279E-02
142 F= -.35948961E+03 E0= -.35949361E+03 d E =-.121471E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359488979347E+03 0.63194E-03 -0.10129E+00 57726 0.327E+00 0.212E-01
DAV: 2 -0.359490616609E+03 -0.16373E-02 -0.20907E-02 64239 0.422E-01 0.138E-01
DAV: 3 -0.359490454030E+03 0.16258E-03 -0.43400E-04 70473 0.827E-02 0.730E-02
DAV: 4 -0.359490443468E+03 0.10563E-04 -0.23636E-04 68658 0.574E-02 0.180E-02
DAV: 5 -0.359490445539E+03 -0.20718E-05 -0.37573E-05 59847 0.235E-02
143 F= -.35949045E+03 E0= -.35949444E+03 d E =-.129783E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359487174614E+03 0.32689E-02 -0.97119E+00 57720 0.102E+01 0.666E-01
DAV: 2 -0.359503027459E+03 -0.15853E-01 -0.20351E-01 64266 0.132E+00 0.439E-01
DAV: 3 -0.359501421673E+03 0.16058E-02 -0.42750E-03 70125 0.271E-01 0.249E-01
DAV: 4 -0.359501226968E+03 0.19471E-03 -0.27177E-03 68442 0.193E-01 0.646E-02
DAV: 5 -0.359501246485E+03 -0.19517E-04 -0.45894E-04 66561 0.878E-02 0.293E-02
DAV: 6 -0.359501249547E+03 -0.30620E-05 -0.77338E-05 64482 0.286E-02
144 F= -.35950125E+03 E0= -.35950524E+03 d E =-.108040E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359501080245E+03 0.16624E-03 -0.32415E-01 57774 0.186E+00 0.123E-01
DAV: 2 -0.359501616575E+03 -0.53633E-03 -0.68464E-03 64320 0.242E-01 0.806E-02
DAV: 3 -0.359501565521E+03 0.51054E-04 -0.14563E-04 70251 0.496E-02 0.447E-02
DAV: 4 -0.359501561145E+03 0.43751E-05 -0.86970E-05 68469 0.346E-02
145 F= -.35950156E+03 E0= -.35950555E+03 d E =-.111156E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359500086764E+03 0.14788E-02 -0.66650E+00 57720 0.846E+00 0.553E-01
DAV: 2 -0.359510995698E+03 -0.10909E-01 -0.14047E-01 65445 0.110E+00 0.374E-01
DAV: 3 -0.359509868975E+03 0.11267E-02 -0.31245E-03 70026 0.236E-01 0.212E-01
DAV: 4 -0.359509723929E+03 0.14505E-03 -0.19687E-03 68271 0.166E-01 0.543E-02
DAV: 5 -0.359509741896E+03 -0.17967E-04 -0.33742E-04 66687 0.723E-02 0.255E-02
DAV: 6 -0.359509743297E+03 -0.14007E-05 -0.56226E-05 64653 0.246E-02
146 F= -.35950974E+03 E0= -.35951373E+03 d E =-.818215E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359509705601E+03 0.36295E-04 -0.12483E-01 57846 0.116E+00 0.769E-02
DAV: 2 -0.359509915429E+03 -0.20983E-03 -0.26725E-03 65490 0.152E-01 0.520E-02
DAV: 3 -0.359509895515E+03 0.19914E-04 -0.61067E-05 67548 0.328E-02 0.291E-02
DAV: 4 -0.359509893532E+03 0.19826E-05 -0.35445E-05 59712 0.225E-02
147 F= -.35950989E+03 E0= -.35951388E+03 d E =-.833239E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359509524554E+03 0.37096E-03 -0.57907E+00 57720 0.787E+00 0.520E-01
DAV: 2 -0.359518786895E+03 -0.92623E-02 -0.12013E-01 66138 0.103E+00 0.335E-01
DAV: 3 -0.359517821290E+03 0.96560E-03 -0.27758E-03 69657 0.207E-01 0.183E-01
DAV: 4 -0.359517740387E+03 0.80904E-04 -0.14514E-03 68226 0.141E-01 0.472E-02
DAV: 5 -0.359517751931E+03 -0.11544E-04 -0.23983E-04 67002 0.615E-02 0.210E-02
DAV: 6 -0.359517753467E+03 -0.15360E-05 -0.37158E-05 61377 0.196E-02
148 F= -.35951775E+03 E0= -.35952174E+03 d E =-.785993E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359517636263E+03 0.11567E-03 -0.38148E-01 57732 0.202E+00 0.134E-01
DAV: 2 -0.359518250875E+03 -0.61461E-03 -0.79508E-03 65985 0.264E-01 0.864E-02
DAV: 3 -0.359518189737E+03 0.61139E-04 -0.18710E-04 69588 0.532E-02 0.465E-02
DAV: 4 -0.359518185774E+03 0.39629E-05 -0.92775E-05 68235 0.359E-02
149 F= -.35951819E+03 E0= -.35952217E+03 d E =-.829224E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359517857274E+03 0.33246E-03 -0.60312E+00 57720 0.806E+00 0.533E-01
DAV: 2 -0.359527429968E+03 -0.95727E-02 -0.12388E-01 66228 0.104E+00 0.355E-01
DAV: 3 -0.359526385311E+03 0.10447E-02 -0.27076E-03 70242 0.225E-01 0.204E-01
DAV: 4 -0.359526264163E+03 0.12115E-03 -0.18503E-03 68235 0.159E-01 0.530E-02
DAV: 5 -0.359526272209E+03 -0.80463E-05 -0.33009E-04 69621 0.764E-02 0.235E-02
DAV: 6 -0.359526273717E+03 -0.15079E-05 -0.50279E-05 63978 0.235E-02
150 F= -.35952627E+03 E0= -.35953026E+03 d E =-.808794E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359526203562E+03 0.68647E-04 -0.35915E-01 57726 0.197E+00 0.130E-01
DAV: 2 -0.359526779750E+03 -0.57619E-03 -0.74424E-03 66192 0.256E-01 0.868E-02
DAV: 3 -0.359526720030E+03 0.59720E-04 -0.16309E-04 70233 0.549E-02 0.492E-02
DAV: 4 -0.359526714118E+03 0.59129E-05 -0.11046E-04 68244 0.390E-02 0.127E-02
DAV: 5 -0.359526714204E+03 -0.86786E-07 -0.18017E-05 44664 0.189E-02
151 F= -.35952671E+03 E0= -.35953070E+03 d E =-.852843E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359525881360E+03 0.83276E-03 -0.59995E+00 57720 0.805E+00 0.527E-01
DAV: 2 -0.359535473795E+03 -0.95924E-02 -0.12393E-01 66147 0.104E+00 0.358E-01
DAV: 3 -0.359534395087E+03 0.10787E-02 -0.27522E-03 70026 0.227E-01 0.203E-01
DAV: 4 -0.359534273801E+03 0.12129E-03 -0.18709E-03 66588 0.160E-01 0.518E-02
DAV: 5 -0.359534285635E+03 -0.11833E-04 -0.31574E-04 69108 0.718E-02 0.244E-02
DAV: 6 -0.359534287084E+03 -0.14497E-05 -0.47617E-05 64662 0.226E-02
152 F= -.35953429E+03 E0= -.35953828E+03 d E =-.757288E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359534171915E+03 0.11372E-03 -0.27312E-01 57732 0.172E+00 0.113E-01
DAV: 2 -0.359534615969E+03 -0.44405E-03 -0.57099E-03 66228 0.224E-01 0.771E-02
DAV: 3 -0.359534568542E+03 0.47427E-04 -0.12803E-04 69999 0.491E-02 0.435E-02
DAV: 4 -0.359534564348E+03 0.41943E-05 -0.86970E-05 67245 0.348E-02
153 F= -.35953456E+03 E0= -.35953855E+03 d E =-.785014E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359533784932E+03 0.78361E-03 -0.58481E+00 57720 0.796E+00 0.529E-01
DAV: 2 -0.359542911610E+03 -0.91267E-02 -0.12018E-01 67749 0.104E+00 0.342E-01
DAV: 3 -0.359541948677E+03 0.96293E-03 -0.27001E-03 69018 0.210E-01 0.189E-01
DAV: 4 -0.359541890604E+03 0.58073E-04 -0.15373E-03 67326 0.146E-01 0.491E-02
DAV: 5 -0.359541901392E+03 -0.10787E-04 -0.26790E-04 68262 0.671E-02 0.211E-02
DAV: 6 -0.359541902382E+03 -0.99090E-06 -0.37829E-05 59118 0.203E-02
154 F= -.35954190E+03 E0= -.35954589E+03 d E =-.733803E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359541741081E+03 0.16031E-03 -0.56391E-01 57732 0.247E+00 0.165E-01
DAV: 2 -0.359542621965E+03 -0.88088E-03 -0.11632E-02 67650 0.322E-01 0.106E-01
DAV: 3 -0.359542533355E+03 0.88610E-04 -0.26539E-04 69162 0.654E-02 0.580E-02
DAV: 4 -0.359542529568E+03 0.37868E-05 -0.14606E-04 67902 0.450E-02 0.150E-02
DAV: 5 -0.359542530340E+03 -0.77230E-06 -0.23663E-05 49803 0.205E-02
155 F= -.35954253E+03 E0= -.35954652E+03 d E =-.796599E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359543711167E+03 -0.11816E-02 -0.37816E+00 57720 0.643E+00 0.438E-01
DAV: 2 -0.359549578477E+03 -0.58673E-02 -0.79554E-02 66228 0.852E-01 0.298E-01
DAV: 3 -0.359548858804E+03 0.71967E-03 -0.20155E-03 68880 0.193E-01 0.173E-01
DAV: 4 -0.359548772476E+03 0.86328E-04 -0.14925E-03 65292 0.140E-01 0.495E-02
DAV: 5 -0.359548767191E+03 0.52848E-05 -0.23327E-04 73248 0.695E-02 0.205E-02
DAV: 6 -0.359548769399E+03 -0.22080E-05 -0.53867E-05 62331 0.232E-02
156 F= -.35954877E+03 E0= -.35955276E+03 d E =-.623906E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359548771757E+03 -0.45659E-05 -0.13498E-01 57738 0.122E+00 0.838E-02
DAV: 2 -0.359548984464E+03 -0.21271E-03 -0.28702E-03 66291 0.162E-01 0.566E-02
DAV: 3 -0.359548960896E+03 0.23568E-04 -0.73830E-05 68979 0.364E-02 0.328E-02
DAV: 4 -0.359548958408E+03 0.24879E-05 -0.52766E-05 61890 0.265E-02
157 F= -.35954896E+03 E0= -.35955294E+03 d E =-.642807E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359549189940E+03 -0.22904E-03 -0.37709E+00 57720 0.642E+00 0.439E-01
DAV: 2 -0.359554968484E+03 -0.57785E-02 -0.78200E-02 67803 0.846E-01 0.286E-01
DAV: 3 -0.359554328639E+03 0.63985E-03 -0.19979E-03 69855 0.185E-01 0.162E-01
DAV: 4 -0.359554285731E+03 0.42908E-04 -0.11447E-03 65454 0.124E-01 0.452E-02
DAV: 5 -0.359554290281E+03 -0.45502E-05 -0.18560E-04 70296 0.575E-02 0.184E-02
DAV: 6 -0.359554291160E+03 -0.87932E-06 -0.32246E-05 59514 0.184E-02
158 F= -.35955429E+03 E0= -.35955828E+03 d E =-.533275E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359554274066E+03 0.16215E-04 -0.15542E-01 57726 0.130E+00 0.901E-02
DAV: 2 -0.359554515310E+03 -0.24124E-03 -0.32532E-03 67713 0.173E-01 0.586E-02
DAV: 3 -0.359554490796E+03 0.24513E-04 -0.84456E-05 69558 0.377E-02 0.329E-02
DAV: 4 -0.359554489869E+03 0.92765E-06 -0.46297E-05 63564 0.251E-02
159 F= -.35955449E+03 E0= -.35955848E+03 d E =-.553146E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359555165931E+03 -0.67513E-03 -0.37396E+00 57720 0.639E+00 0.440E-01
DAV: 2 -0.359560737936E+03 -0.55720E-02 -0.75854E-02 69306 0.830E-01 0.278E-01
DAV: 3 -0.359560095303E+03 0.64263E-03 -0.19195E-03 68919 0.176E-01 0.151E-01
DAV: 4 -0.359560065003E+03 0.30300E-04 -0.94561E-04 65013 0.110E-01 0.404E-02
DAV: 5 -0.359560072299E+03 -0.72964E-05 -0.16077E-04 69333 0.517E-02 0.163E-02
DAV: 6 -0.359560072022E+03 0.27676E-06 -0.18320E-05 40938 0.151E-02
160 F= -.35956007E+03 E0= -.35956406E+03 d E =-.558215E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359560074589E+03 -0.22894E-05 -0.20827E-01 57726 0.151E+00 0.104E-01
DAV: 2 -0.359560384172E+03 -0.30958E-03 -0.42432E-03 69225 0.197E-01 0.658E-02
DAV: 3 -0.359560350806E+03 0.33366E-04 -0.10933E-04 68973 0.416E-02 0.353E-02
DAV: 4 -0.359560349890E+03 0.91593E-06 -0.52645E-05 64950 0.261E-02
161 F= -.35956035E+03 E0= -.35956434E+03 d E =-.586002E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359560951978E+03 -0.60117E-03 -0.29481E+00 57720 0.568E+00 0.388E-01
DAV: 2 -0.359565282154E+03 -0.43302E-02 -0.58505E-02 66300 0.732E-01 0.267E-01
DAV: 3 -0.359564697077E+03 0.58508E-03 -0.15960E-03 69351 0.180E-01 0.149E-01
DAV: 4 -0.359564642093E+03 0.54983E-04 -0.10682E-03 65976 0.115E-01 0.400E-02
DAV: 5 -0.359564638092E+03 0.40010E-05 -0.17222E-04 71313 0.573E-02 0.176E-02
DAV: 6 -0.359564639366E+03 -0.12737E-05 -0.31508E-05 57525 0.178E-02
162 F= -.35956464E+03 E0= -.35956863E+03 d E =-.428948E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359564641110E+03 -0.30177E-05 -0.32797E-03 59106 0.190E-01 0.141E-02
DAV: 2 -0.359564646742E+03 -0.56316E-05 -0.70873E-05 63978 0.258E-02
163 F= -.35956465E+03 E0= -.35956864E+03 d E =-.429685E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359565930330E+03 -0.12892E-02 -0.20190E+00 57720 0.467E+00 0.328E-01
DAV: 2 -0.359568792078E+03 -0.28617E-02 -0.39765E-02 68136 0.602E-01 0.210E-01
DAV: 3 -0.359568420168E+03 0.37191E-03 -0.11112E-03 68757 0.135E-01 0.108E-01
DAV: 4 -0.359568409174E+03 0.10993E-04 -0.50365E-04 66669 0.782E-02 0.296E-02
DAV: 5 -0.359568412490E+03 -0.33154E-05 -0.74478E-05 67020 0.339E-02
164 F= -.35956841E+03 E0= -.35957240E+03 d E =-.376575E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359568378204E+03 0.30970E-04 -0.19732E-01 57726 0.146E+00 0.103E-01
DAV: 2 -0.359568671383E+03 -0.29318E-03 -0.39150E-03 67965 0.189E-01 0.653E-02
DAV: 3 -0.359568640377E+03 0.31006E-04 -0.10444E-04 68784 0.414E-02 0.338E-02
DAV: 4 -0.359568640415E+03 -0.38812E-07 -0.47096E-05 65184 0.241E-02
165 F= -.35956864E+03 E0= -.35957263E+03 d E =-.399367E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359570617422E+03 -0.19770E-02 -0.13961E+00 57720 0.388E+00 0.275E-01
DAV: 2 -0.359572542597E+03 -0.19252E-02 -0.26970E-02 67587 0.497E-01 0.174E-01
DAV: 3 -0.359572315965E+03 0.22663E-03 -0.73493E-04 68874 0.109E-01 0.914E-02
DAV: 4 -0.359572309621E+03 0.63434E-05 -0.35249E-04 65571 0.669E-02 0.238E-02
DAV: 5 -0.359572310582E+03 -0.96050E-06 -0.57250E-05 65508 0.314E-02
166 F= -.35957231E+03 E0= -.35957630E+03 d E =-.367017E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359572519258E+03 -0.20964E-03 -0.56313E-01 57720 0.246E+00 0.175E-01
DAV: 2 -0.359573303588E+03 -0.78433E-03 -0.10879E-02 67407 0.315E-01 0.111E-01
DAV: 3 -0.359573219100E+03 0.84489E-04 -0.29502E-04 68955 0.687E-02 0.575E-02
DAV: 4 -0.359573218147E+03 0.95233E-06 -0.13783E-04 65553 0.419E-02 0.149E-02
DAV: 5 -0.359573218156E+03 -0.82509E-08 -0.20388E-05 45582 0.197E-02
167 F= -.35957322E+03 E0= -.35957721E+03 d E =-.457774E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359575170027E+03 -0.19519E-02 -0.90384E-01 57720 0.314E+00 0.224E-01
DAV: 2 -0.359576552695E+03 -0.13827E-02 -0.19109E-02 66345 0.417E-01 0.154E-01
DAV: 3 -0.359576357609E+03 0.19509E-03 -0.54226E-04 70611 0.101E-01 0.848E-02
DAV: 4 -0.359576328390E+03 0.29219E-04 -0.35552E-04 64788 0.653E-02 0.219E-02
DAV: 5 -0.359576326616E+03 0.17736E-05 -0.51645E-05 63861 0.320E-02
168 F= -.35957633E+03 E0= -.35958031E+03 d E =-.310846E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359576416524E+03 -0.88134E-04 -0.65874E-02 57834 0.849E-01 0.616E-02
DAV: 2 -0.359576522488E+03 -0.10596E-03 -0.14128E-03 66390 0.113E-01 0.421E-02
DAV: 3 -0.359576509052E+03 0.13436E-04 -0.38022E-05 61215 0.271E-02 0.231E-02
DAV: 4 -0.359576507196E+03 0.18561E-05 -0.27815E-05 53880 0.185E-02
169 F= -.35957651E+03 E0= -.35958050E+03 d E =-.328904E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359578248781E+03 -0.17397E-02 -0.10356E+00 57720 0.334E+00 0.237E-01
DAV: 2 -0.359579668162E+03 -0.14194E-02 -0.20056E-02 66399 0.430E-01 0.150E-01
DAV: 3 -0.359579503023E+03 0.16514E-03 -0.59818E-04 68685 0.940E-02 0.755E-02
DAV: 4 -0.359579502663E+03 0.35932E-06 -0.24382E-04 66426 0.552E-02 0.202E-02
DAV: 5 -0.359579503192E+03 -0.52851E-06 -0.34229E-05 54438 0.249E-02
170 F= -.35957950E+03 E0= -.35958349E+03 d E =-.299600E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359579716137E+03 -0.21347E-03 -0.35420E-01 57720 0.195E+00 0.139E-01
DAV: 2 -0.359580207835E+03 -0.49170E-03 -0.68571E-03 66381 0.251E-01 0.877E-02
DAV: 3 -0.359580155599E+03 0.52236E-04 -0.20262E-04 68766 0.546E-02 0.437E-02
DAV: 4 -0.359580156824E+03 -0.12246E-05 -0.80165E-05 64194 0.316E-02
171 F= -.35958016E+03 E0= -.35958415E+03 d E =-.364963E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359582222402E+03 -0.20668E-02 -0.12274E+00 57720 0.363E+00 0.253E-01
DAV: 2 -0.359583907314E+03 -0.16849E-02 -0.23521E-02 67596 0.465E-01 0.162E-01
DAV: 3 -0.359583692684E+03 0.21463E-03 -0.64734E-04 68730 0.101E-01 0.812E-02
DAV: 4 -0.359583688928E+03 0.37555E-05 -0.31334E-04 66390 0.632E-02 0.208E-02
DAV: 5 -0.359583688395E+03 0.53356E-06 -0.46477E-05 63879 0.277E-02
172 F= -.35958369E+03 E0= -.35958768E+03 d E =-.353157E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359583940477E+03 -0.25155E-03 -0.27218E-01 57720 0.171E+00 0.119E-01
DAV: 2 -0.359584320364E+03 -0.37989E-03 -0.52354E-03 67326 0.219E-01 0.764E-02
DAV: 3 -0.359584276349E+03 0.44015E-04 -0.14296E-04 69054 0.473E-02 0.379E-02
DAV: 4 -0.359584276315E+03 0.34479E-07 -0.67600E-05 64023 0.294E-02
173 F= -.35958428E+03 E0= -.35958827E+03 d E =-.411949E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359586080245E+03 -0.18039E-02 -0.10291E+00 57720 0.333E+00 0.229E-01
DAV: 2 -0.359587526494E+03 -0.14462E-02 -0.19736E-02 66300 0.424E-01 0.155E-01
DAV: 3 -0.359587336146E+03 0.19035E-03 -0.59574E-04 69045 0.104E-01 0.792E-02
DAV: 4 -0.359587324703E+03 0.11443E-04 -0.28200E-04 67263 0.582E-02 0.208E-02
DAV: 5 -0.359587325415E+03 -0.71212E-06 -0.38282E-05 56958 0.245E-02
174 F= -.35958733E+03 E0= -.35959131E+03 d E =-.304910E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359587553042E+03 -0.22834E-03 -0.20393E-01 57726 0.148E+00 0.103E-01
DAV: 2 -0.359587846418E+03 -0.29338E-03 -0.39366E-03 66300 0.189E-01 0.689E-02
DAV: 3 -0.359587810544E+03 0.35874E-04 -0.11648E-04 68964 0.458E-02 0.353E-02
DAV: 4 -0.359587808738E+03 0.18061E-05 -0.55634E-05 64572 0.258E-02
175 F= -.35958781E+03 E0= -.35959180E+03 d E =-.353242E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359589467133E+03 -0.16566E-02 -0.10621E+00 57720 0.337E+00 0.232E-01
DAV: 2 -0.359590952136E+03 -0.14850E-02 -0.20436E-02 66309 0.431E-01 0.148E-01
DAV: 3 -0.359590787495E+03 0.16464E-03 -0.57785E-04 69063 0.913E-02 0.732E-02
DAV: 4 -0.359590787387E+03 0.10844E-06 -0.21766E-04 66993 0.520E-02 0.188E-02
DAV: 5 -0.359590789064E+03 -0.16770E-05 -0.28906E-05 52980 0.214E-02
176 F= -.35959079E+03 E0= -.35959478E+03 d E =-.298033E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359591026362E+03 -0.23898E-03 -0.33288E-01 57726 0.188E+00 0.130E-01
DAV: 2 -0.359591495239E+03 -0.46888E-03 -0.64079E-03 66300 0.241E-01 0.829E-02
DAV: 3 -0.359591446858E+03 0.48381E-04 -0.17999E-04 69171 0.508E-02 0.404E-02
DAV: 4 -0.359591447638E+03 -0.78040E-06 -0.65551E-05 64545 0.286E-02
177 F= -.35959145E+03 E0= -.35959544E+03 d E =-.363890E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359593075143E+03 -0.16283E-02 -0.13269E+00 57720 0.375E+00 0.254E-01
DAV: 2 -0.359594919432E+03 -0.18443E-02 -0.25335E-02 66282 0.477E-01 0.164E-01
DAV: 3 -0.359594710286E+03 0.20915E-03 -0.69534E-04 70125 0.100E-01 0.824E-02
DAV: 4 -0.359594706747E+03 0.35392E-05 -0.29221E-04 66786 0.612E-02 0.219E-02
DAV: 5 -0.359594708642E+03 -0.18952E-05 -0.44611E-05 62547 0.274E-02
178 F= -.35959471E+03 E0= -.35959870E+03 d E =-.326100E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359594938009E+03 -0.23126E-03 -0.50893E-01 57726 0.232E+00 0.157E-01
DAV: 2 -0.359595655525E+03 -0.71752E-03 -0.97667E-03 66282 0.296E-01 0.102E-01
DAV: 3 -0.359595579421E+03 0.76104E-04 -0.26502E-04 70314 0.616E-02 0.508E-02
DAV: 4 -0.359595579212E+03 0.20898E-06 -0.10944E-04 66597 0.375E-02 0.135E-02
DAV: 5 -0.359595579665E+03 -0.45332E-06 -0.15152E-05 44871 0.168E-02
179 F= -.35959558E+03 E0= -.35959957E+03 d E =-.413203E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359596606762E+03 -0.10276E-02 -0.14175E+00 57720 0.387E+00 0.255E-01
DAV: 2 -0.359598725854E+03 -0.21191E-02 -0.28125E-02 66219 0.494E-01 0.175E-01
DAV: 3 -0.359598466125E+03 0.25973E-03 -0.67767E-04 69909 0.110E-01 0.923E-02
DAV: 4 -0.359598446231E+03 0.19895E-04 -0.40284E-04 67506 0.717E-02 0.229E-02
DAV: 5 -0.359598447855E+03 -0.16244E-05 -0.62793E-05 65283 0.305E-02
180 F= -.35959845E+03 E0= -.35960244E+03 d E =-.286819E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359598479500E+03 -0.33270E-04 -0.16495E-01 57738 0.132E+00 0.880E-02
DAV: 2 -0.359598733828E+03 -0.25433E-03 -0.32978E-03 66210 0.169E-01 0.601E-02
DAV: 3 -0.359598706423E+03 0.27405E-04 -0.77058E-05 69945 0.374E-02 0.319E-02
DAV: 4 -0.359598705019E+03 0.14040E-05 -0.47404E-05 62610 0.247E-02
181 F= -.35959871E+03 E0= -.35960269E+03 d E =-.312535E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359599505258E+03 -0.79884E-03 -0.14139E+00 57720 0.385E+00 0.252E-01
DAV: 2 -0.359601558663E+03 -0.20534E-02 -0.26980E-02 66021 0.481E-01 0.165E-01
DAV: 3 -0.359601339807E+03 0.21886E-03 -0.59435E-04 68883 0.966E-02 0.814E-02
DAV: 4 -0.359601339230E+03 0.57665E-06 -0.29513E-04 67758 0.607E-02 0.190E-02
DAV: 5 -0.359601340622E+03 -0.13918E-05 -0.46344E-05 63771 0.262E-02
182 F= -.35960134E+03 E0= -.35960533E+03 d E =-.263560E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359601221310E+03 0.11792E-03 -0.10431E+00 57720 0.330E+00 0.216E-01
DAV: 2 -0.359602742220E+03 -0.15209E-02 -0.19929E-02 66039 0.413E-01 0.141E-01
DAV: 3 -0.359602584219E+03 0.15800E-03 -0.43710E-04 68919 0.825E-02 0.694E-02
DAV: 4 -0.359602585006E+03 -0.78695E-06 -0.21302E-04 67614 0.516E-02 0.161E-02
DAV: 5 -0.359602585929E+03 -0.92290E-06 -0.32495E-05 55815 0.220E-02
183 F= -.35960259E+03 E0= -.35960657E+03 d E =-.388091E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359596842698E+03 0.57423E-02 -0.41713E+00 57720 0.661E+00 0.433E-01
DAV: 2 -0.359602944137E+03 -0.61014E-02 -0.79989E-02 66003 0.828E-01 0.283E-01
DAV: 3 -0.359602278196E+03 0.66594E-03 -0.17560E-03 68748 0.165E-01 0.140E-01
DAV: 4 -0.359602266976E+03 0.11220E-04 -0.86929E-04 67938 0.104E-01 0.325E-02
DAV: 5 -0.359602271602E+03 -0.46257E-05 -0.13718E-04 65643 0.448E-02 0.158E-02
DAV: 6 -0.359602271836E+03 -0.23476E-06 -0.12777E-05 42189 0.127E-02
184 F= -.35960227E+03 E0= -.35960626E+03 d E =-.356682E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359600966148E+03 0.13055E-02 -0.15390E+00 57720 0.401E+00 0.260E-01
DAV: 2 -0.359603159144E+03 -0.21930E-02 -0.29056E-02 65904 0.500E-01 0.171E-01
DAV: 3 -0.359602911714E+03 0.24743E-03 -0.65497E-04 68820 0.101E-01 0.836E-02
DAV: 4 -0.359602908149E+03 0.35653E-05 -0.31296E-04 66939 0.623E-02 0.195E-02
DAV: 5 -0.359602909631E+03 -0.14822E-05 -0.48147E-05 65472 0.262E-02
185 F= -.35960291E+03 E0= -.35960690E+03 d E =-.420461E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359604093910E+03 -0.11858E-02 -0.86403E-01 57720 0.300E+00 0.194E-01
DAV: 2 -0.359605323227E+03 -0.12293E-02 -0.16404E-02 65985 0.375E-01 0.128E-01
DAV: 3 -0.359605183260E+03 0.13997E-03 -0.36554E-04 68838 0.752E-02 0.642E-02
DAV: 4 -0.359605178577E+03 0.46838E-05 -0.18233E-04 67632 0.469E-02 0.150E-02
DAV: 5 -0.359605179602E+03 -0.10251E-05 -0.27742E-05 55014 0.205E-02
186 F= -.35960518E+03 E0= -.35960916E+03 d E =-.226997E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359601592913E+03 0.35857E-02 -0.45276E+00 57720 0.687E+00 0.449E-01
DAV: 2 -0.359608238134E+03 -0.66452E-02 -0.86824E-02 66012 0.862E-01 0.295E-01
DAV: 3 -0.359607520406E+03 0.71773E-03 -0.19048E-03 68721 0.172E-01 0.149E-01
DAV: 4 -0.359607496591E+03 0.23815E-04 -0.94835E-04 67875 0.107E-01 0.345E-02
DAV: 5 -0.359607503176E+03 -0.65850E-05 -0.15114E-04 66264 0.469E-02 0.169E-02
DAV: 6 -0.359607503304E+03 -0.12820E-06 -0.14414E-05 42072 0.138E-02
187 F= -.35960750E+03 E0= -.35961149E+03 d E =-.459367E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359608622677E+03 -0.11195E-02 -0.97963E-01 57720 0.321E+00 0.209E-01
DAV: 2 -0.359610129659E+03 -0.15070E-02 -0.19664E-02 66003 0.412E-01 0.139E-01
DAV: 3 -0.359609973437E+03 0.15622E-03 -0.41891E-04 69072 0.818E-02 0.731E-02
DAV: 4 -0.359609964964E+03 0.84733E-05 -0.23443E-04 67506 0.552E-02 0.166E-02
DAV: 5 -0.359609966700E+03 -0.17362E-05 -0.36824E-05 61053 0.233E-02
188 F= -.35960997E+03 E0= -.35961395E+03 d E =-.246340E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359608787128E+03 0.11778E-02 -0.17540E+00 57720 0.430E+00 0.281E-01
DAV: 2 -0.359611501747E+03 -0.27146E-02 -0.35187E-02 66048 0.550E-01 0.187E-01
DAV: 3 -0.359611224254E+03 0.27749E-03 -0.74233E-04 69045 0.109E-01 0.981E-02
DAV: 4 -0.359611209292E+03 0.14962E-04 -0.41817E-04 67659 0.736E-02 0.223E-02
DAV: 5 -0.359611212368E+03 -0.30755E-05 -0.66602E-05 65553 0.312E-02
189 F= -.35961121E+03 E0= -.35961520E+03 d E =-.370906E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359611726650E+03 -0.51736E-03 -0.13174E+00 57720 0.373E+00 0.243E-01
DAV: 2 -0.359613810708E+03 -0.20841E-02 -0.26483E-02 66021 0.476E-01 0.157E-01
DAV: 3 -0.359613635568E+03 0.17514E-03 -0.56144E-04 68937 0.890E-02 0.806E-02
DAV: 4 -0.359613636162E+03 -0.59399E-06 -0.26298E-04 67254 0.601E-02 0.188E-02
DAV: 5 -0.359613637909E+03 -0.17462E-05 -0.41035E-05 61629 0.250E-02
190 F= -.35961364E+03 E0= -.35961762E+03 d E =-.242554E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359613190526E+03 0.44564E-03 -0.96549E-01 57720 0.320E+00 0.207E-01
DAV: 2 -0.359614716357E+03 -0.15258E-02 -0.19390E-02 66021 0.407E-01 0.134E-01
DAV: 3 -0.359614588248E+03 0.12811E-03 -0.40758E-04 69018 0.760E-02 0.687E-02
DAV: 4 -0.359614588852E+03 -0.60383E-06 -0.19148E-04 67101 0.511E-02 0.160E-02
DAV: 5 -0.359614590082E+03 -0.12302E-05 -0.29214E-05 55257 0.212E-02
191 F= -.35961459E+03 E0= -.35961857E+03 d E =-.337771E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359614494377E+03 0.94475E-04 -0.12421E-01 57798 0.115E+00 0.748E-02
DAV: 2 -0.359614692685E+03 -0.19831E-03 -0.25007E-03 65985 0.146E-01 0.479E-02
DAV: 3 -0.359614677929E+03 0.14756E-04 -0.50681E-05 64464 0.271E-02 0.246E-02
DAV: 4 -0.359614678412E+03 -0.48361E-06 -0.23763E-05 51684 0.184E-02
192 F= -.35961468E+03 E0= -.35961866E+03 d E =-.346604E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359614943208E+03 -0.26528E-03 -0.13821E+00 57720 0.383E+00 0.245E-01
DAV: 2 -0.359617129996E+03 -0.21868E-02 -0.27803E-02 65904 0.483E-01 0.162E-01
DAV: 3 -0.359616918412E+03 0.21158E-03 -0.56465E-04 69639 0.957E-02 0.837E-02
DAV: 4 -0.359616908534E+03 0.98780E-05 -0.29662E-04 67245 0.615E-02 0.191E-02
DAV: 5 -0.359616911015E+03 -0.24807E-05 -0.48149E-05 63204 0.260E-02
193 F= -.35961691E+03 E0= -.35962089E+03 d E =-.223260E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359616874315E+03 0.34219E-04 -0.20798E-01 57726 0.149E+00 0.960E-02
DAV: 2 -0.359617212236E+03 -0.33792E-03 -0.42296E-03 65877 0.188E-01 0.629E-02
DAV: 3 -0.359617183423E+03 0.28814E-04 -0.82758E-05 69729 0.366E-02 0.326E-02
DAV: 4 -0.359617182835E+03 0.58757E-06 -0.44066E-05 63375 0.238E-02
194 F= -.35961718E+03 E0= -.35962116E+03 d E =-.250442E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359617667121E+03 -0.48370E-03 -0.87496E-01 57720 0.306E+00 0.195E-01
DAV: 2 -0.359619131646E+03 -0.14645E-02 -0.18384E-02 65634 0.393E-01 0.130E-01
DAV: 3 -0.359618994777E+03 0.13687E-03 -0.38995E-04 69387 0.784E-02 0.682E-02
DAV: 4 -0.359618985121E+03 0.96566E-05 -0.17987E-04 67398 0.494E-02 0.160E-02
DAV: 5 -0.359618988185E+03 -0.30644E-05 -0.29598E-05 56949 0.192E-02
195 F= -.35961899E+03 E0= -.35962297E+03 d E =-.180535E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359619016338E+03 -0.31218E-04 -0.76054E-02 57768 0.902E-01 0.577E-02
DAV: 2 -0.359619146415E+03 -0.13008E-03 -0.16113E-03 65589 0.116E-01 0.380E-02
DAV: 3 -0.359619135742E+03 0.10673E-04 -0.31976E-05 61377 0.229E-02 0.202E-02
DAV: 4 -0.359619135217E+03 0.52498E-06 -0.15668E-05 42819 0.152E-02
196 F= -.35961914E+03 E0= -.35962311E+03 d E =-.195238E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359619872269E+03 -0.73653E-03 -0.71295E-01 57720 0.274E+00 0.173E-01
DAV: 2 -0.359621048965E+03 -0.11767E-02 -0.14744E-02 65688 0.350E-01 0.113E-01
DAV: 3 -0.359620950363E+03 0.98602E-04 -0.28162E-04 69918 0.631E-02 0.597E-02
DAV: 4 -0.359620946173E+03 0.41899E-05 -0.13426E-04 67128 0.431E-02 0.133E-02
DAV: 5 -0.359620948024E+03 -0.18511E-05 -0.22596E-05 53205 0.174E-02
197 F= -.35962095E+03 E0= -.35962493E+03 d E =-.181281E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359620926988E+03 0.19185E-04 -0.54330E-01 57720 0.239E+00 0.151E-01
DAV: 2 -0.359621828971E+03 -0.90198E-03 -0.11261E-02 65607 0.306E-01 0.985E-02
DAV: 3 -0.359621755000E+03 0.73972E-04 -0.21248E-04 69963 0.549E-02 0.520E-02
DAV: 4 -0.359621752147E+03 0.28533E-05 -0.10119E-04 67119 0.373E-02 0.115E-02
DAV: 5 -0.359621753535E+03 -0.13881E-05 -0.17040E-05 50991 0.151E-02
198 F= -.35962175E+03 E0= -.35962573E+03 d E =-.261832E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359622723023E+03 -0.97088E-03 -0.79448E-01 57720 0.290E+00 0.183E-01
DAV: 2 -0.359624078690E+03 -0.13557E-02 -0.16910E-02 65841 0.376E-01 0.123E-01
DAV: 3 -0.359623965247E+03 0.11344E-03 -0.31130E-04 69900 0.695E-02 0.676E-02
DAV: 4 -0.359623954540E+03 0.10708E-04 -0.18019E-04 67002 0.499E-02 0.148E-02
DAV: 5 -0.359623956822E+03 -0.22828E-05 -0.33878E-05 59118 0.221E-02
199 F= -.35962396E+03 E0= -.35962793E+03 d E =-.220329E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359623415097E+03 0.53944E-03 -0.83411E-01 57720 0.297E+00 0.189E-01
DAV: 2 -0.359624848983E+03 -0.14339E-02 -0.17828E-02 65850 0.386E-01 0.126E-01
DAV: 3 -0.359624731612E+03 0.11737E-03 -0.32642E-04 69936 0.710E-02 0.695E-02
DAV: 4 -0.359624720943E+03 0.10669E-04 -0.18987E-04 66930 0.512E-02 0.152E-02
DAV: 5 -0.359624723207E+03 -0.22639E-05 -0.35935E-05 60009 0.229E-02
200 F= -.35962472E+03 E0= -.35962870E+03 d E =-.296967E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359625284288E+03 -0.56335E-03 -0.33453E-01 57720 0.188E+00 0.120E-01
DAV: 2 -0.359625852422E+03 -0.56813E-03 -0.70385E-03 65211 0.241E-01 0.776E-02
DAV: 3 -0.359625811386E+03 0.41036E-04 -0.12641E-04 69558 0.432E-02 0.420E-02
DAV: 4 -0.359625810572E+03 0.81411E-06 -0.68253E-05 66984 0.310E-02
201 F= -.35962581E+03 E0= -.35962979E+03 d E =-.108737E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359626146281E+03 -0.33489E-03 -0.16107E-01 57738 0.130E+00 0.842E-02
DAV: 2 -0.359626418150E+03 -0.27187E-03 -0.33678E-03 65418 0.167E-01 0.540E-02
DAV: 3 -0.359626399104E+03 0.19046E-04 -0.60340E-05 67389 0.304E-02 0.294E-02
DAV: 4 -0.359626399062E+03 0.41913E-07 -0.33202E-05 57660 0.217E-02
202 F= -.35962640E+03 E0= -.35963037E+03 d E =-.167586E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359626176930E+03 0.22217E-03 -0.64145E-01 57720 0.260E+00 0.166E-01
DAV: 2 -0.359627251636E+03 -0.10747E-02 -0.13396E-02 65283 0.333E-01 0.107E-01
DAV: 3 -0.359627168598E+03 0.83038E-04 -0.24423E-04 69585 0.603E-02 0.582E-02
DAV: 4 -0.359627165352E+03 0.32461E-05 -0.13232E-04 67290 0.431E-02 0.131E-02
DAV: 5 -0.359627166990E+03 -0.16384E-05 -0.23558E-05 52980 0.185E-02
203 F= -.35962717E+03 E0= -.35963114E+03 d E =-.244378E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359623118970E+03 0.40464E-02 -0.25612E+00 57720 0.519E+00 0.330E-01
DAV: 2 -0.359627423539E+03 -0.43046E-02 -0.53579E-02 65184 0.666E-01 0.214E-01
DAV: 3 -0.359627079439E+03 0.34410E-03 -0.97841E-04 69297 0.120E-01 0.116E-01
DAV: 4 -0.359627060440E+03 0.18998E-04 -0.52263E-04 67335 0.857E-02 0.258E-02
DAV: 5 -0.359627067055E+03 -0.66152E-05 -0.96414E-05 65184 0.366E-02
204 F= -.35962707E+03 E0= -.35963104E+03 d E =-.234385E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359626128654E+03 0.93179E-03 -0.85683E-01 57720 0.300E+00 0.189E-01
DAV: 2 -0.359627514975E+03 -0.13863E-02 -0.17694E-02 64878 0.384E-01 0.124E-01
DAV: 3 -0.359627394099E+03 0.12088E-03 -0.33976E-04 69243 0.709E-02 0.673E-02
DAV: 4 -0.359627386711E+03 0.73882E-05 -0.18168E-04 65589 0.504E-02 0.153E-02
DAV: 5 -0.359627389033E+03 -0.23218E-05 -0.32530E-05 57975 0.216E-02
205 F= -.35962739E+03 E0= -.35963136E+03 d E =-.266583E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359628405762E+03 -0.10191E-02 -0.72370E-01 57720 0.277E+00 0.172E-01
DAV: 2 -0.359629580918E+03 -0.11752E-02 -0.14777E-02 65283 0.352E-01 0.114E-01
DAV: 3 -0.359629470742E+03 0.11018E-03 -0.27489E-04 69765 0.655E-02 0.602E-02
DAV: 4 -0.359629463400E+03 0.73426E-05 -0.15166E-04 67596 0.458E-02 0.132E-02
DAV: 5 -0.359629464853E+03 -0.14533E-05 -0.25574E-05 53763 0.192E-02
206 F= -.35962946E+03 E0= -.35963344E+03 d E =-.207582E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359627907562E+03 0.15558E-02 -0.20182E+00 57720 0.463E+00 0.291E-01
DAV: 2 -0.359631245396E+03 -0.33378E-02 -0.41411E-02 65337 0.589E-01 0.190E-01
DAV: 3 -0.359630951611E+03 0.29379E-03 -0.75543E-04 69585 0.109E-01 0.100E-01
DAV: 4 -0.359630936576E+03 0.15035E-04 -0.41252E-04 67614 0.755E-02 0.219E-02
DAV: 5 -0.359630940722E+03 -0.41463E-05 -0.72635E-05 64950 0.315E-02
207 F= -.35963094E+03 E0= -.35963491E+03 d E =-.355169E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359631638345E+03 -0.70177E-03 -0.91263E-01 57720 0.313E+00 0.200E-01
DAV: 2 -0.359633199673E+03 -0.15613E-02 -0.19246E-02 65409 0.401E-01 0.132E-01
DAV: 3 -0.359633055379E+03 0.14429E-03 -0.38406E-04 70278 0.822E-02 0.712E-02
DAV: 4 -0.359633044045E+03 0.11334E-04 -0.21061E-04 66885 0.532E-02 0.168E-02
DAV: 5 -0.359633046893E+03 -0.28486E-05 -0.35837E-05 61845 0.212E-02
208 F= -.35963305E+03 E0= -.35963702E+03 d E =-.210617E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359633006645E+03 0.37399E-04 -0.29963E-01 57720 0.179E+00 0.115E-01
DAV: 2 -0.359633525609E+03 -0.51896E-03 -0.63661E-03 65319 0.230E-01 0.758E-02
DAV: 3 -0.359633479393E+03 0.46216E-04 -0.12368E-04 70359 0.467E-02 0.411E-02
DAV: 4 -0.359633475934E+03 0.34597E-05 -0.70875E-05 66903 0.309E-02
209 F= -.35963348E+03 E0= -.35963744E+03 d E =-.253521E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359634454332E+03 -0.97494E-03 -0.51682E-01 57720 0.235E+00 0.152E-01
DAV: 2 -0.359635287225E+03 -0.83289E-03 -0.10640E-02 65796 0.302E-01 0.100E-01
DAV: 3 -0.359635211244E+03 0.75981E-04 -0.23117E-04 69153 0.596E-02 0.532E-02
DAV: 4 -0.359635208416E+03 0.28280E-05 -0.11882E-04 67947 0.397E-02 0.133E-02
DAV: 5 -0.359635209051E+03 -0.63499E-06 -0.19180E-05 47301 0.174E-02
210 F= -.35963521E+03 E0= -.35963918E+03 d E =-.173312E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359635448682E+03 -0.24027E-03 -0.21839E-01 57720 0.153E+00 0.989E-02
DAV: 2 -0.359635803733E+03 -0.35505E-03 -0.45095E-03 65895 0.196E-01 0.649E-02
DAV: 3 -0.359635771975E+03 0.31758E-04 -0.96113E-05 69198 0.384E-02 0.343E-02
DAV: 4 -0.359635771015E+03 0.95947E-06 -0.49234E-05 66147 0.255E-02
211 F= -.35963577E+03 E0= -.35963974E+03 d E =-.229508E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359635802343E+03 -0.30368E-04 -0.54341E-02 57744 0.761E-01 0.504E-02
DAV: 2 -0.359635891497E+03 -0.89154E-04 -0.11200E-03 65958 0.980E-02 0.327E-02
DAV: 3 -0.359635884051E+03 0.74457E-05 -0.22014E-05 53088 0.195E-02
212 F= -.35963588E+03 E0= -.35963985E+03 d E =-.240812E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359636951216E+03 -0.10597E-02 -0.50376E-01 57720 0.231E+00 0.151E-01
DAV: 2 -0.359637692605E+03 -0.74139E-03 -0.97444E-03 66039 0.293E-01 0.979E-02
DAV: 3 -0.359637620611E+03 0.71995E-04 -0.23022E-04 69900 0.578E-02 0.507E-02
DAV: 4 -0.359637619853E+03 0.75757E-06 -0.10295E-04 67749 0.362E-02 0.127E-02
DAV: 5 -0.359637620565E+03 -0.71159E-06 -0.14314E-05 41550 0.152E-02
213 F= -.35963762E+03 E0= -.35964159E+03 d E =-.173651E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359637039392E+03 0.58046E-03 -0.12995E+00 57720 0.371E+00 0.240E-01
DAV: 2 -0.359638998888E+03 -0.19595E-02 -0.25535E-02 65985 0.474E-01 0.156E-01
DAV: 3 -0.359638804976E+03 0.19391E-03 -0.58314E-04 69684 0.925E-02 0.812E-02
DAV: 4 -0.359638799789E+03 0.51873E-05 -0.26710E-04 67884 0.580E-02 0.201E-02
DAV: 5 -0.359638802184E+03 -0.23952E-05 -0.40915E-05 61215 0.243E-02
214 F= -.35963880E+03 E0= -.35964277E+03 d E =-.291813E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359639581842E+03 -0.78205E-03 -0.82970E-01 57720 0.296E+00 0.193E-01
DAV: 2 -0.359640815272E+03 -0.12334E-02 -0.16113E-02 64788 0.376E-01 0.127E-01
DAV: 3 -0.359640680916E+03 0.13436E-03 -0.35785E-04 69441 0.771E-02 0.650E-02
DAV: 4 -0.359640675317E+03 0.55991E-05 -0.18204E-04 67992 0.478E-02 0.153E-02
DAV: 5 -0.359640676634E+03 -0.13171E-05 -0.28264E-05 55662 0.201E-02
215 F= -.35964068E+03 E0= -.35964464E+03 d E =-.187445E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359640182159E+03 0.49316E-03 -0.89943E-01 57720 0.308E+00 0.200E-01
DAV: 2 -0.359641520322E+03 -0.13382E-02 -0.17502E-02 64815 0.392E-01 0.133E-01
DAV: 3 -0.359641373145E+03 0.14718E-03 -0.38857E-04 69477 0.804E-02 0.679E-02
DAV: 4 -0.359641366310E+03 0.68350E-05 -0.19964E-04 67983 0.500E-02 0.160E-02
DAV: 5 -0.359641367739E+03 -0.14289E-05 -0.31486E-05 56967 0.212E-02
216 F= -.35964137E+03 E0= -.35964533E+03 d E =-.256556E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359642253411E+03 -0.88710E-03 -0.45772E-01 57720 0.220E+00 0.143E-01
DAV: 2 -0.359642932848E+03 -0.67944E-03 -0.88169E-03 64374 0.277E-01 0.934E-02
DAV: 3 -0.359642861647E+03 0.71201E-04 -0.18852E-04 69360 0.542E-02 0.467E-02
DAV: 4 -0.359642860379E+03 0.12677E-05 -0.92045E-05 68280 0.333E-02
217 F= -.35964286E+03 E0= -.35964683E+03 d E =-.149264E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359643343748E+03 -0.48210E-03 -0.22106E-01 57720 0.153E+00 0.100E-01
DAV: 2 -0.359643673816E+03 -0.33007E-03 -0.42477E-03 64491 0.192E-01 0.653E-02
DAV: 3 -0.359643640162E+03 0.33654E-04 -0.90378E-05 69522 0.383E-02 0.329E-02
DAV: 4 -0.359643639830E+03 0.33239E-06 -0.44406E-05 64527 0.232E-02
218 F= -.35964364E+03 E0= -.35964761E+03 d E =-.227209E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359643420126E+03 0.22004E-03 -0.88028E-01 57720 0.304E+00 0.198E-01
DAV: 2 -0.359644712490E+03 -0.12924E-02 -0.16858E-02 64356 0.383E-01 0.130E-01
DAV: 3 -0.359644572545E+03 0.13994E-03 -0.36395E-04 69297 0.759E-02 0.648E-02
DAV: 4 -0.359644569235E+03 0.33108E-05 -0.17826E-04 68181 0.463E-02 0.151E-02
DAV: 5 -0.359644570082E+03 -0.84720E-06 -0.26518E-05 55689 0.199E-02
219 F= -.35964457E+03 E0= -.35964853E+03 d E =-.320234E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359639373077E+03 0.51962E-02 -0.35145E+00 57720 0.608E+00 0.393E-01
DAV: 2 -0.359644511423E+03 -0.51383E-02 -0.67277E-02 64302 0.765E-01 0.258E-01
DAV: 3 -0.359643946633E+03 0.56479E-03 -0.14649E-03 69189 0.151E-01 0.128E-01
DAV: 4 -0.359643931705E+03 0.14928E-04 -0.70564E-04 67983 0.921E-02 0.299E-02
DAV: 5 -0.359643935392E+03 -0.36870E-05 -0.10689E-04 66039 0.393E-02 0.142E-02
DAV: 6 -0.359643935393E+03 -0.78398E-09 -0.93235E-06 40785 0.108E-02
220 F= -.35964394E+03 E0= -.35964790E+03 d E =-.256765E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359642466114E+03 0.14693E-02 -0.17701E+00 57720 0.431E+00 0.280E-01
DAV: 2 -0.359645018968E+03 -0.25529E-02 -0.33739E-02 64239 0.543E-01 0.183E-01
DAV: 3 -0.359644731256E+03 0.28771E-03 -0.73452E-04 69126 0.107E-01 0.922E-02
DAV: 4 -0.359644724067E+03 0.71886E-05 -0.35899E-04 67956 0.656E-02 0.214E-02
DAV: 5 -0.359644726628E+03 -0.25607E-05 -0.54656E-05 65247 0.282E-02
221 F= -.35964473E+03 E0= -.35964869E+03 d E =-.335889E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359645634341E+03 -0.91027E-03 -0.10021E+00 57720 0.324E+00 0.208E-01
DAV: 2 -0.359647019548E+03 -0.13852E-02 -0.18688E-02 64617 0.404E-01 0.138E-01
DAV: 3 -0.359646845809E+03 0.17374E-03 -0.42370E-04 69252 0.816E-02 0.663E-02
DAV: 4 -0.359646842652E+03 0.31573E-05 -0.20343E-04 68100 0.487E-02 0.159E-02
DAV: 5 -0.359646843570E+03 -0.91807E-06 -0.28014E-05 56409 0.205E-02
222 F= -.35964684E+03 E0= -.35965081E+03 d E =-.211694E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359645509104E+03 0.13335E-02 -0.20164E+00 57720 0.460E+00 0.297E-01
DAV: 2 -0.359648362157E+03 -0.28531E-02 -0.37803E-02 64680 0.573E-01 0.196E-01
DAV: 3 -0.359648032077E+03 0.33008E-03 -0.84135E-04 69270 0.115E-01 0.939E-02
DAV: 4 -0.359648031862E+03 0.21571E-06 -0.39750E-04 67920 0.681E-02 0.224E-02
DAV: 5 -0.359648033583E+03 -0.17217E-05 -0.56847E-05 65202 0.286E-02
223 F= -.35964803E+03 E0= -.35965200E+03 d E =-.330696E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359648783361E+03 -0.75150E-03 -0.90161E-01 57720 0.308E+00 0.201E-01
DAV: 2 -0.359650076654E+03 -0.12933E-02 -0.17244E-02 64446 0.390E-01 0.135E-01
DAV: 3 -0.359649923962E+03 0.15269E-03 -0.40837E-04 69045 0.808E-02 0.659E-02
DAV: 4 -0.359649921165E+03 0.27970E-05 -0.19024E-04 68118 0.471E-02 0.161E-02
DAV: 5 -0.359649921990E+03 -0.82480E-06 -0.26410E-05 56058 0.201E-02
224 F= -.35964992E+03 E0= -.35965388E+03 d E =-.188841E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359649655153E+03 0.26601E-03 -0.61185E-01 57720 0.254E+00 0.166E-01
DAV: 2 -0.359650532637E+03 -0.87748E-03 -0.11712E-02 64464 0.322E-01 0.111E-01
DAV: 3 -0.359650428630E+03 0.10401E-03 -0.27724E-04 69072 0.666E-02 0.544E-02
DAV: 4 -0.359650426421E+03 0.22093E-05 -0.12976E-04 68154 0.390E-02 0.133E-02
DAV: 5 -0.359650426913E+03 -0.49179E-06 -0.17270E-05 45438 0.167E-02
225 F= -.35965043E+03 E0= -.35965439E+03 d E =-.239333E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359650814374E+03 -0.38795E-03 -0.97420E-01 57720 0.322E+00 0.213E-01
DAV: 2 -0.359652253409E+03 -0.14390E-02 -0.19013E-02 64716 0.412E-01 0.141E-01
DAV: 3 -0.359652081442E+03 0.17197E-03 -0.45800E-04 69063 0.851E-02 0.693E-02
DAV: 4 -0.359652075389E+03 0.60536E-05 -0.20644E-04 68172 0.504E-02 0.174E-02
DAV: 5 -0.359652076368E+03 -0.97912E-06 -0.29624E-05 56895 0.209E-02
226 F= -.35965208E+03 E0= -.35965604E+03 d E =-.164946E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359651995847E+03 0.79542E-04 -0.20738E-01 57726 0.149E+00 0.988E-02
DAV: 2 -0.359652307137E+03 -0.31129E-03 -0.40599E-03 64779 0.190E-01 0.649E-02
DAV: 3 -0.359652271923E+03 0.35214E-04 -0.95827E-05 69135 0.390E-02 0.321E-02
DAV: 4 -0.359652271034E+03 0.88946E-06 -0.43021E-05 64167 0.231E-02
227 F= -.35965227E+03 E0= -.35965623E+03 d E =-.184412E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359652885460E+03 -0.61354E-03 -0.99038E-01 57720 0.324E+00 0.213E-01
DAV: 2 -0.359654285073E+03 -0.13996E-02 -0.18571E-02 64617 0.408E-01 0.140E-01
DAV: 3 -0.359654124205E+03 0.16087E-03 -0.44290E-04 69243 0.840E-02 0.674E-02
DAV: 4 -0.359654123882E+03 0.32306E-06 -0.19338E-04 67713 0.483E-02 0.165E-02
DAV: 5 -0.359654124812E+03 -0.92978E-06 -0.26108E-05 55032 0.196E-02
228 F= -.35965412E+03 E0= -.35965808E+03 d E =-.185378E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359654212419E+03 -0.88537E-04 -0.30616E-01 57720 0.180E+00 0.119E-01
DAV: 2 -0.359654650780E+03 -0.43836E-03 -0.57714E-03 64662 0.227E-01 0.776E-02
DAV: 3 -0.359654602449E+03 0.48331E-04 -0.13573E-04 69459 0.463E-02 0.374E-02
DAV: 4 -0.359654602787E+03 -0.33761E-06 -0.58859E-05 66507 0.267E-02
229 F= -.35965460E+03 E0= -.35965856E+03 d E =-.233175E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359655528418E+03 -0.92597E-03 -0.30729E-01 57726 0.182E+00 0.123E-01
DAV: 2 -0.359655967259E+03 -0.43884E-03 -0.60619E-03 66381 0.238E-01 0.828E-02
DAV: 3 -0.359655904353E+03 0.62906E-04 -0.20739E-04 69324 0.577E-02 0.413E-02
DAV: 4 -0.359655900856E+03 0.34972E-05 -0.71088E-05 65868 0.294E-02
230 F= -.35965590E+03 E0= -.35965986E+03 d E =-.129807E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359655972172E+03 -0.67818E-04 -0.16493E-02 58026 0.422E-01 0.303E-02
DAV: 2 -0.359655997378E+03 -0.25207E-04 -0.32286E-04 66327 0.547E-02 0.199E-02
DAV: 3 -0.359655994600E+03 0.27787E-05 -0.89741E-06 39516 0.132E-02
231 F= -.35965599E+03 E0= -.35965995E+03 d E =-.139181E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359655869434E+03 0.12794E-03 -0.65071E-02 57726 0.839E-01 0.576E-02
DAV: 2 -0.359655959596E+03 -0.90162E-04 -0.12534E-03 66615 0.108E-01 0.385E-02
DAV: 3 -0.359655946665E+03 0.12931E-04 -0.42315E-05 66036 0.261E-02 0.191E-02
DAV: 4 -0.359655946084E+03 0.58094E-06 -0.14678E-05 42063 0.138E-02
232 F= -.35965595E+03 E0= -.35965990E+03 d E =-.134330E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359655982041E+03 -0.35376E-04 -0.28773E-02 57744 0.558E-01 0.370E-02
DAV: 2 -0.359656020694E+03 -0.38654E-04 -0.56727E-04 66399 0.729E-02 0.251E-02
DAV: 3 -0.359656013691E+03 0.70034E-05 -0.17963E-05 43950 0.178E-02
233 F= -.35965601E+03 E0= -.35965997E+03 d E =-.141090E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359656652347E+03 -0.63165E-03 -0.27285E-01 57720 0.172E+00 0.112E-01
DAV: 2 -0.359657043665E+03 -0.39132E-03 -0.53118E-03 66201 0.222E-01 0.740E-02
DAV: 3 -0.359656995726E+03 0.47939E-04 -0.14556E-04 70161 0.466E-02 0.374E-02
DAV: 4 -0.359656991760E+03 0.39660E-05 -0.55459E-05 65409 0.269E-02
234 F= -.35965699E+03 E0= -.35966095E+03 d E =-.978069E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359657097063E+03 -0.10134E-03 -0.19636E-01 57726 0.146E+00 0.976E-02
DAV: 2 -0.359657379956E+03 -0.28289E-03 -0.37687E-03 66228 0.187E-01 0.641E-02
DAV: 3 -0.359657348112E+03 0.31844E-04 -0.10228E-04 70368 0.397E-02 0.324E-02
DAV: 4 -0.359657346391E+03 0.17207E-05 -0.40044E-05 62817 0.229E-02
235 F= -.35965735E+03 E0= -.35966130E+03 d E =-.133270E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359658313233E+03 -0.96512E-03 -0.34245E-01 57720 0.192E+00 0.129E-01
DAV: 2 -0.359658780815E+03 -0.46758E-03 -0.65357E-03 66282 0.247E-01 0.842E-02
DAV: 3 -0.359658720456E+03 0.60359E-04 -0.19403E-04 69639 0.536E-02 0.424E-02
DAV: 4 -0.359658717003E+03 0.34528E-05 -0.75038E-05 65679 0.306E-02
236 F= -.35965872E+03 E0= -.35966267E+03 d E =-.137061E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359658860471E+03 -0.14002E-03 -0.37194E-02 57732 0.632E-01 0.438E-02
DAV: 2 -0.359658913766E+03 -0.53295E-04 -0.71272E-04 66282 0.812E-02 0.284E-02
DAV: 3 -0.359658907606E+03 0.61599E-05 -0.18521E-05 46695 0.181E-02
237 F= -.35965891E+03 E0= -.35966286E+03 d E =-.156121E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359658735094E+03 0.17867E-03 -0.14617E-01 57726 0.125E+00 0.852E-02
DAV: 2 -0.359658928969E+03 -0.19387E-03 -0.27338E-03 66309 0.160E-01 0.555E-02
DAV: 3 -0.359658903916E+03 0.25053E-04 -0.82923E-05 70161 0.348E-02 0.278E-02
DAV: 4 -0.359658902655E+03 0.12610E-05 -0.30864E-05 52530 0.202E-02
238 F= -.35965890E+03 E0= -.35966286E+03 d E =-.155626E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359658923088E+03 -0.19171E-04 -0.42937E-02 57726 0.680E-01 0.445E-02
DAV: 2 -0.359658978737E+03 -0.55649E-04 -0.82063E-04 66282 0.875E-02 0.295E-02
DAV: 3 -0.359658969851E+03 0.88861E-05 -0.23932E-05 50649 0.190E-02
239 F= -.35965897E+03 E0= -.35966292E+03 d E =-.162346E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359659573703E+03 -0.59497E-03 -0.36792E-01 57720 0.198E+00 0.130E-01
DAV: 2 -0.359660080213E+03 -0.50651E-03 -0.70389E-03 66273 0.255E-01 0.855E-02
DAV: 3 -0.359660015680E+03 0.64532E-04 -0.19443E-04 69369 0.547E-02 0.437E-02
DAV: 4 -0.359660010834E+03 0.48463E-05 -0.84745E-05 65976 0.321E-02
240 F= -.35966001E+03 E0= -.35966396E+03 d E =-.104098E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359660140616E+03 -0.12494E-03 -0.55328E-02 57726 0.769E-01 0.529E-02
DAV: 2 -0.359660219831E+03 -0.79215E-04 -0.10506E-03 66291 0.984E-02 0.345E-02
DAV: 3 -0.359660211176E+03 0.86549E-05 -0.27090E-05 55203 0.220E-02
241 F= -.35966021E+03 E0= -.35966416E+03 d E =-.124133E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359660014751E+03 0.20508E-03 -0.21777E-01 57720 0.153E+00 0.104E-01
DAV: 2 -0.359660304817E+03 -0.29007E-03 -0.40295E-03 66291 0.194E-01 0.674E-02
DAV: 3 -0.359660270453E+03 0.34364E-04 -0.11563E-04 70131 0.420E-02 0.345E-02
DAV: 4 -0.359660269198E+03 0.12548E-05 -0.51105E-05 63888 0.251E-02
242 F= -.35966027E+03 E0= -.35966422E+03 d E =-.129935E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359660249638E+03 0.20814E-04 -0.46169E-02 57726 0.703E-01 0.458E-02
DAV: 2 -0.359660308513E+03 -0.58875E-04 -0.86732E-04 66282 0.900E-02 0.301E-02
DAV: 3 -0.359660299726E+03 0.87870E-05 -0.24250E-05 51099 0.192E-02
243 F= -.35966030E+03 E0= -.35966425E+03 d E =-.132987E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359660921897E+03 -0.61338E-03 -0.39679E-01 57720 0.206E+00 0.135E-01
DAV: 2 -0.359661503359E+03 -0.58146E-03 -0.78276E-03 67794 0.266E-01 0.866E-02
DAV: 3 -0.359661433723E+03 0.69636E-04 -0.20246E-04 69477 0.544E-02 0.435E-02
DAV: 4 -0.359661428911E+03 0.48119E-05 -0.82382E-05 66156 0.326E-02
244 F= -.35966143E+03 E0= -.35966538E+03 d E =-.112919E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359661566942E+03 -0.13322E-03 -0.56057E-02 57726 0.775E-01 0.533E-02
DAV: 2 -0.359661650711E+03 -0.83769E-04 -0.10911E-03 67821 0.992E-02 0.337E-02
DAV: 3 -0.359661641985E+03 0.87260E-05 -0.26222E-05 52044 0.210E-02
245 F= -.35966164E+03 E0= -.35966559E+03 d E =-.134226E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359661444347E+03 0.20636E-03 -0.22051E-01 57720 0.154E+00 0.104E-01
DAV: 2 -0.359661757792E+03 -0.31345E-03 -0.42094E-03 67929 0.195E-01 0.661E-02
DAV: 3 -0.359661722651E+03 0.35142E-04 -0.11364E-04 69837 0.406E-02 0.329E-02
DAV: 4 -0.359661721557E+03 0.10935E-05 -0.45136E-05 63150 0.245E-02
246 F= -.35966172E+03 E0= -.35966567E+03 d E =-.142183E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359661697571E+03 0.25080E-04 -0.39313E-02 57720 0.650E-01 0.418E-02
DAV: 2 -0.359661751975E+03 -0.54405E-04 -0.76616E-04 67866 0.835E-02 0.272E-02
DAV: 3 -0.359661744412E+03 0.75629E-05 -0.19645E-05 45870 0.172E-02
247 F= -.35966174E+03 E0= -.35966570E+03 d E =-.144469E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359662368021E+03 -0.61605E-03 -0.39335E-01 57720 0.206E+00 0.134E-01
DAV: 2 -0.359662928956E+03 -0.56094E-03 -0.75648E-03 66219 0.261E-01 0.887E-02
DAV: 3 -0.359662861935E+03 0.67021E-04 -0.19428E-04 69252 0.593E-02 0.464E-02
DAV: 4 -0.359662856780E+03 0.51548E-05 -0.10302E-04 66849 0.361E-02 0.119E-02
DAV: 5 -0.359662856991E+03 -0.21040E-06 -0.14780E-05 40200 0.161E-02
248 F= -.35966286E+03 E0= -.35966681E+03 d E =-.111258E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359662783465E+03 0.73316E-04 -0.39172E-01 57720 0.205E+00 0.136E-01
DAV: 2 -0.359663342225E+03 -0.55876E-03 -0.74522E-03 66264 0.259E-01 0.894E-02
DAV: 3 -0.359663279299E+03 0.62925E-04 -0.19189E-04 69549 0.593E-02 0.466E-02
DAV: 4 -0.359663276212E+03 0.30878E-05 -0.10209E-04 66507 0.359E-02 0.120E-02
DAV: 5 -0.359663276242E+03 -0.29928E-07 -0.14530E-05 40434 0.162E-02
249 F= -.35966328E+03 E0= -.35966723E+03 d E =-.153183E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359663884125E+03 -0.60791E-03 -0.56839E-01 57720 0.247E+00 0.166E-01
DAV: 2 -0.359664655642E+03 -0.77152E-03 -0.10643E-02 68298 0.312E-01 0.105E-01
DAV: 3 -0.359664562627E+03 0.93015E-04 -0.27268E-04 69117 0.691E-02 0.543E-02
DAV: 4 -0.359664559327E+03 0.33001E-05 -0.14277E-04 68082 0.425E-02 0.144E-02
DAV: 5 -0.359664559330E+03 -0.28103E-08 -0.22437E-05 48381 0.200E-02
250 F= -.35966456E+03 E0= -.35966851E+03 d E =-.128309E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359664314616E+03 0.24471E-03 -0.59033E-01 57720 0.252E+00 0.169E-01
DAV: 2 -0.359665117107E+03 -0.80249E-03 -0.11049E-02 68262 0.318E-01 0.107E-01
DAV: 3 -0.359665021083E+03 0.96024E-04 -0.28347E-04 69153 0.703E-02 0.552E-02
DAV: 4 -0.359665018009E+03 0.30739E-05 -0.14659E-04 68037 0.430E-02 0.146E-02
DAV: 5 -0.359665018033E+03 -0.24185E-07 -0.23046E-05 48804 0.202E-02
251 F= -.35966502E+03 E0= -.35966897E+03 d E =-.174179E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359665192836E+03 -0.17483E-03 -0.68323E-01 57720 0.271E+00 0.182E-01
DAV: 2 -0.359666139063E+03 -0.94623E-03 -0.12931E-02 67947 0.346E-01 0.115E-01
DAV: 3 -0.359666034288E+03 0.10478E-03 -0.37902E-04 70647 0.745E-02 0.591E-02
DAV: 4 -0.359666030511E+03 0.37774E-05 -0.14240E-04 67038 0.432E-02 0.162E-02
DAV: 5 -0.359666031694E+03 -0.11829E-05 -0.22503E-05 48084 0.187E-02
252 F= -.35966603E+03 E0= -.35966998E+03 d E =-.101366E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359666021278E+03 0.92327E-05 -0.59958E-02 57738 0.803E-01 0.546E-02
DAV: 2 -0.359666106932E+03 -0.85654E-04 -0.11392E-03 67884 0.102E-01 0.342E-02
DAV: 3 -0.359666098286E+03 0.86464E-05 -0.30454E-05 54816 0.219E-02
253 F= -.35966610E+03 E0= -.35967005E+03 d E =-.108025E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359666430251E+03 -0.32332E-03 -0.45403E-01 57720 0.221E+00 0.150E-01
DAV: 2 -0.359667025527E+03 -0.59528E-03 -0.85542E-03 66300 0.282E-01 0.991E-02
DAV: 3 -0.359666950300E+03 0.75227E-04 -0.26621E-04 70638 0.647E-02 0.522E-02
DAV: 4 -0.359666945163E+03 0.51364E-05 -0.12020E-04 65274 0.378E-02 0.142E-02
DAV: 5 -0.359666944985E+03 0.17780E-06 -0.19206E-05 48039 0.192E-02
254 F= -.35966694E+03 E0= -.35967089E+03 d E =-.846700E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359666948781E+03 -0.36181E-05 -0.40383E-02 57744 0.659E-01 0.452E-02
DAV: 2 -0.359667004428E+03 -0.55647E-04 -0.76848E-04 66300 0.841E-02 0.296E-02
DAV: 3 -0.359666998035E+03 0.63936E-05 -0.21534E-05 52260 0.191E-02
255 F= -.35966700E+03 E0= -.35967095E+03 d E =-.899749E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359667272938E+03 -0.26851E-03 -0.50591E-01 57720 0.233E+00 0.155E-01
DAV: 2 -0.359667921915E+03 -0.64898E-03 -0.91029E-03 68352 0.288E-01 0.993E-02
DAV: 3 -0.359667843378E+03 0.78537E-04 -0.26687E-04 70539 0.623E-02 0.492E-02
DAV: 4 -0.359667841467E+03 0.19118E-05 -0.10051E-04 67605 0.353E-02 0.131E-02
DAV: 5 -0.359667841637E+03 -0.17012E-06 -0.14810E-05 41964 0.159E-02
256 F= -.35966784E+03 E0= -.35967179E+03 d E =-.843602E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359667845786E+03 -0.43194E-05 -0.38091E-02 57726 0.639E-01 0.426E-02
DAV: 2 -0.359667896791E+03 -0.51006E-04 -0.69330E-04 68172 0.792E-02 0.272E-02
DAV: 3 -0.359667890966E+03 0.58254E-05 -0.17712E-05 47247 0.170E-02
257 F= -.35966789E+03 E0= -.35967184E+03 d E =-.892931E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359668238655E+03 -0.34186E-03 -0.48955E-01 57720 0.229E+00 0.150E-01
DAV: 2 -0.359668824841E+03 -0.58619E-03 -0.83806E-03 66912 0.278E-01 0.974E-02
DAV: 3 -0.359668742958E+03 0.81883E-04 -0.25879E-04 70782 0.648E-02 0.468E-02
DAV: 4 -0.359668742792E+03 0.16615E-06 -0.11092E-04 67965 0.358E-02 0.130E-02
DAV: 5 -0.359668742200E+03 0.59194E-06 -0.14344E-05 40542 0.161E-02
258 F= -.35966874E+03 E0= -.35967269E+03 d E =-.851234E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359668750284E+03 -0.74919E-05 -0.68277E-02 57720 0.854E-01 0.563E-02
DAV: 2 -0.359668835216E+03 -0.84932E-04 -0.11856E-03 66849 0.104E-01 0.364E-02
DAV: 3 -0.359668823751E+03 0.11465E-04 -0.34534E-05 58848 0.244E-02 0.174E-02
DAV: 4 -0.359668823854E+03 -0.10298E-06 -0.16101E-05 40218 0.141E-02
259 F= -.35966882E+03 E0= -.35967277E+03 d E =-.932888E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359669040054E+03 -0.21630E-03 -0.42648E-01 57720 0.214E+00 0.143E-01
DAV: 2 -0.359669605244E+03 -0.56519E-03 -0.79380E-03 65913 0.271E-01 0.927E-02
DAV: 3 -0.359669537282E+03 0.67962E-04 -0.24594E-04 70539 0.619E-02 0.474E-02
DAV: 4 -0.359669532860E+03 0.44219E-05 -0.94485E-05 68226 0.334E-02
260 F= -.35966953E+03 E0= -.35967348E+03 d E =-.709006E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359669545674E+03 -0.83917E-05 -0.32069E-03 58302 0.186E-01 0.151E-02
DAV: 2 -0.359669550977E+03 -0.53032E-05 -0.62935E-05 62133 0.239E-02
261 F= -.35966955E+03 E0= -.35967350E+03 d E =-.727123E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359669756533E+03 -0.21086E-03 -0.44768E-01 57720 0.220E+00 0.150E-01
DAV: 2 -0.359670354113E+03 -0.59758E-03 -0.84298E-03 66435 0.280E-01 0.955E-02
DAV: 3 -0.359670284309E+03 0.69803E-04 -0.30571E-04 69153 0.625E-02 0.455E-02
DAV: 4 -0.359670282806E+03 0.15035E-05 -0.76646E-05 67983 0.326E-02
262 F= -.35967028E+03 E0= -.35967423E+03 d E =-.731829E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359670282692E+03 0.16178E-05 -0.89229E-05 60432 0.323E-02 0.510E-03
DAV: 2 -0.359670282599E+03 0.92647E-07 -0.31738E-06 33720 0.607E-03
263 F= -.35967028E+03 E0= -.35967423E+03 d E =-.731622E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359670617512E+03 -0.33482E-03 -0.34280E-01 57720 0.193E+00 0.128E-01
DAV: 2 -0.359671062548E+03 -0.44504E-03 -0.62200E-03 66408 0.240E-01 0.807E-02
DAV: 3 -0.359671016420E+03 0.46129E-04 -0.17601E-04 68901 0.505E-02 0.407E-02
DAV: 4 -0.359671015810E+03 0.60927E-06 -0.69039E-05 67092 0.292E-02
264 F= -.35967102E+03 E0= -.35967497E+03 d E =-.733211E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359671109255E+03 -0.92836E-04 -0.43363E-02 57744 0.685E-01 0.473E-02
DAV: 2 -0.359671169081E+03 -0.59826E-04 -0.79420E-04 66498 0.854E-02 0.296E-02
DAV: 3 -0.359671163978E+03 0.51027E-05 -0.19443E-05 47157 0.186E-02
265 F= -.35967116E+03 E0= -.35967511E+03 d E =-.881379E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359671089900E+03 0.79181E-04 -0.17050E-01 57720 0.136E+00 0.920E-02
DAV: 2 -0.359671307043E+03 -0.21714E-03 -0.30338E-03 66534 0.168E-01 0.576E-02
DAV: 3 -0.359671286312E+03 0.20731E-04 -0.87270E-05 69099 0.356E-02 0.292E-02
DAV: 4 -0.359671286551E+03 -0.23913E-06 -0.33390E-05 58065 0.208E-02
266 F= -.35967129E+03 E0= -.35967524E+03 d E =-.100395E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359671594100E+03 -0.30779E-03 -0.12834E-01 57720 0.118E+00 0.779E-02
DAV: 2 -0.359671767308E+03 -0.17321E-03 -0.23070E-03 65202 0.145E-01 0.493E-02
DAV: 3 -0.359671751044E+03 0.16264E-04 -0.59023E-05 69675 0.316E-02 0.245E-02
DAV: 4 -0.359671751300E+03 -0.25605E-06 -0.24076E-05 49758 0.179E-02
267 F= -.35967175E+03 E0= -.35967570E+03 d E =-.464749E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359671093185E+03 0.65786E-03 -0.11516E+00 57720 0.353E+00 0.231E-01
DAV: 2 -0.359672626500E+03 -0.15333E-02 -0.20685E-02 65157 0.433E-01 0.147E-01
DAV: 3 -0.359672468131E+03 0.15837E-03 -0.53302E-04 69459 0.935E-02 0.723E-02
DAV: 4 -0.359672468386E+03 -0.25524E-06 -0.23317E-04 68649 0.535E-02 0.178E-02
DAV: 5 -0.359672468361E+03 0.24924E-07 -0.38926E-05 58173 0.242E-02
268 F= -.35967247E+03 E0= -.35967642E+03 d E =-.118181E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359672873119E+03 -0.40473E-03 -0.20039E-01 57720 0.148E+00 0.978E-02
DAV: 2 -0.359673162421E+03 -0.28930E-03 -0.38053E-03 66192 0.186E-01 0.615E-02
DAV: 3 -0.359673136460E+03 0.25961E-04 -0.10344E-04 70107 0.390E-02 0.304E-02
DAV: 4 -0.359673136228E+03 0.23223E-06 -0.37279E-05 59964 0.225E-02
269 F= -.35967314E+03 E0= -.35967708E+03 d E =-.667866E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359673194960E+03 -0.58500E-04 -0.12638E-01 57726 0.117E+00 0.782E-02
DAV: 2 -0.359673376424E+03 -0.18146E-03 -0.23940E-03 66237 0.148E-01 0.491E-02
DAV: 3 -0.359673359837E+03 0.16587E-04 -0.64839E-05 70305 0.314E-02 0.245E-02
DAV: 4 -0.359673359525E+03 0.31259E-06 -0.22766E-05 46221 0.180E-02
270 F= -.35967336E+03 E0= -.35967731E+03 d E =-.891163E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359673675558E+03 -0.31572E-03 -0.95290E-02 57723 0.102E+00 0.694E-02
DAV: 2 -0.359673819706E+03 -0.14415E-03 -0.19034E-03 66759 0.132E-01 0.444E-02
DAV: 3 -0.359673806307E+03 0.13400E-04 -0.48917E-05 65397 0.299E-02 0.249E-02
DAV: 4 -0.359673805363E+03 0.94373E-06 -0.28420E-05 53151 0.192E-02
271 F= -.35967381E+03 E0= -.35967775E+03 d E =-.445839E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359673836735E+03 -0.30428E-04 -0.11859E-01 57726 0.114E+00 0.776E-02
DAV: 2 -0.359674016723E+03 -0.17999E-03 -0.23738E-03 66786 0.147E-01 0.498E-02
DAV: 3 -0.359673999948E+03 0.16775E-04 -0.61499E-05 70386 0.334E-02 0.280E-02
DAV: 4 -0.359673998652E+03 0.12965E-05 -0.36005E-05 61674 0.214E-02
272 F= -.35967400E+03 E0= -.35967795E+03 d E =-.639127E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359674253976E+03 -0.25403E-03 -0.82756E-02 57720 0.953E-01 0.653E-02
DAV: 2 -0.359674376817E+03 -0.12284E-03 -0.16224E-03 66318 0.122E-01 0.395E-02
DAV: 3 -0.359674368105E+03 0.87120E-05 -0.41583E-05 63087 0.258E-02
273 F= -.35967437E+03 E0= -.35967832E+03 d E =-.369453E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359673778285E+03 0.59853E-03 -0.73964E-01 57720 0.285E+00 0.195E-01
DAV: 2 -0.359674838401E+03 -0.10601E-02 -0.14235E-02 66345 0.361E-01 0.118E-01
DAV: 3 -0.359674759950E+03 0.78451E-04 -0.39125E-04 69180 0.763E-02 0.637E-02
DAV: 4 -0.359674760888E+03 -0.93840E-06 -0.17150E-04 65346 0.497E-02 0.176E-02
DAV: 5 -0.359674759986E+03 0.90236E-06 -0.27302E-05 52395 0.223E-02
274 F= -.35967476E+03 E0= -.35967871E+03 d E =-.761334E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359674944664E+03 -0.18378E-03 -0.11060E-01 57726 0.110E+00 0.745E-02
DAV: 2 -0.359675112528E+03 -0.16786E-03 -0.21757E-03 65859 0.140E-01 0.451E-02
DAV: 3 -0.359675101548E+03 0.10980E-04 -0.49300E-05 66291 0.289E-02 0.249E-02
DAV: 4 -0.359675101794E+03 -0.24588E-06 -0.23796E-05 48624 0.185E-02
275 F= -.35967510E+03 E0= -.35967905E+03 d E =-.341808E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359674748662E+03 0.35289E-03 -0.55255E-01 57720 0.246E+00 0.166E-01
DAV: 2 -0.359675574314E+03 -0.82565E-03 -0.10872E-02 65823 0.313E-01 0.101E-01
DAV: 3 -0.359675514269E+03 0.60045E-04 -0.25948E-04 69468 0.656E-02 0.559E-02
DAV: 4 -0.359675513364E+03 0.90443E-06 -0.12636E-04 65706 0.417E-02 0.151E-02
DAV: 5 -0.359675513373E+03 -0.88839E-08 -0.22180E-05 50172 0.200E-02
276 F= -.35967551E+03 E0= -.35967946E+03 d E =-.753388E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359675910680E+03 -0.39732E-03 -0.44116E-02 57726 0.702E-01 0.464E-02
DAV: 2 -0.359675981626E+03 -0.70947E-04 -0.91361E-04 67848 0.908E-02 0.298E-02
DAV: 3 -0.359675974798E+03 0.68285E-05 -0.23906E-05 53925 0.211E-02
277 F= -.35967597E+03 E0= -.35967993E+03 d E =-.461424E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359676098763E+03 -0.11714E-03 -0.13858E-01 57720 0.124E+00 0.833E-02
DAV: 2 -0.359676310315E+03 -0.21155E-03 -0.27977E-03 67929 0.159E-01 0.538E-02
DAV: 3 -0.359676288269E+03 0.22047E-04 -0.79856E-05 70395 0.372E-02 0.301E-02
DAV: 4 -0.359676286254E+03 0.20144E-05 -0.39369E-05 60270 0.231E-02
278 F= -.35967629E+03 E0= -.35968024E+03 d E =-.772881E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359676568351E+03 -0.28008E-03 -0.47766E-02 57750 0.723E-01 0.475E-02
DAV: 2 -0.359676644386E+03 -0.76034E-04 -0.95995E-04 69180 0.910E-02 0.293E-02
DAV: 3 -0.359676638694E+03 0.56914E-05 -0.21355E-05 51810 0.185E-02
279 F= -.35967664E+03 E0= -.35968059E+03 d E =-.352440E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359676547962E+03 0.96424E-04 -0.25047E-01 57720 0.166E+00 0.108E-01
DAV: 2 -0.359676933922E+03 -0.38596E-03 -0.49485E-03 69171 0.207E-01 0.673E-02
DAV: 3 -0.359676903360E+03 0.30562E-04 -0.12455E-04 69558 0.416E-02 0.368E-02
DAV: 4 -0.359676901245E+03 0.21153E-05 -0.49001E-05 63510 0.274E-02
280 F= -.35967690E+03 E0= -.35968085E+03 d E =-.614990E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359676890534E+03 0.12825E-04 -0.13548E-02 57780 0.386E-01 0.232E-02
DAV: 2 -0.359676910811E+03 -0.20277E-04 -0.27341E-04 68271 0.488E-02 0.155E-02
DAV: 3 -0.359676908525E+03 0.22866E-05 -0.64719E-06 34161 0.972E-03
281 F= -.35967691E+03 E0= -.35968086E+03 d E =-.622270E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359677188643E+03 -0.27783E-03 -0.32767E-02 57738 0.602E-01 0.402E-02
DAV: 2 -0.359677242306E+03 -0.53664E-04 -0.74227E-04 66651 0.829E-02 0.259E-02
DAV: 3 -0.359677236151E+03 0.61551E-05 -0.18691E-05 46869 0.178E-02
282 F= -.35967724E+03 E0= -.35968119E+03 d E =-.327627E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359677305557E+03 -0.63251E-04 -0.59134E-02 57720 0.809E-01 0.576E-02
DAV: 2 -0.359677392457E+03 -0.86900E-04 -0.12610E-03 67479 0.109E-01 0.362E-02
DAV: 3 -0.359677383116E+03 0.93414E-05 -0.38052E-05 61368 0.240E-02
283 F= -.35967738E+03 E0= -.35968133E+03 d E =-.474591E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359677633779E+03 -0.24132E-03 -0.48006E-02 57732 0.723E-01 0.508E-02
DAV: 2 -0.359677705373E+03 -0.71595E-04 -0.95995E-04 66300 0.932E-02 0.300E-02
DAV: 3 -0.359677701823E+03 0.35503E-05 -0.26326E-05 52548 0.197E-02
284 F= -.35967770E+03 E0= -.35968165E+03 d E =-.318707E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359677588570E+03 0.11680E-03 -0.28580E-01 57720 0.176E+00 0.119E-01
DAV: 2 -0.359678038108E+03 -0.44954E-03 -0.58141E-03 66300 0.228E-01 0.706E-02
DAV: 3 -0.359678012249E+03 0.25858E-04 -0.14910E-04 70665 0.465E-02 0.400E-02
DAV: 4 -0.359678013821E+03 -0.15715E-05 -0.70659E-05 64275 0.315E-02
285 F= -.35967801E+03 E0= -.35968197E+03 d E =-.630705E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359678250377E+03 -0.23813E-03 -0.36017E-02 57762 0.625E-01 0.415E-02
DAV: 2 -0.359678309440E+03 -0.59064E-04 -0.72921E-04 66300 0.793E-02 0.249E-02
DAV: 3 -0.359678306277E+03 0.31638E-05 -0.14427E-05 44682 0.168E-02
286 F= -.35967831E+03 E0= -.35968226E+03 d E =-.292456E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359678324067E+03 -0.14627E-04 -0.31974E-01 57720 0.187E+00 0.119E-01
DAV: 2 -0.359678829570E+03 -0.50550E-03 -0.63326E-03 66300 0.234E-01 0.725E-02
DAV: 3 -0.359678797970E+03 0.31600E-04 -0.14283E-04 69630 0.469E-02 0.397E-02
DAV: 4 -0.359678798258E+03 -0.28754E-06 -0.65658E-05 66264 0.307E-02
287 F= -.35967880E+03 E0= -.35968275E+03 d E =-.784437E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359679114858E+03 -0.31689E-03 -0.36114E-02 57798 0.631E-01 0.424E-02
DAV: 2 -0.359679178880E+03 -0.64023E-04 -0.79496E-04 66300 0.832E-02 0.271E-02
DAV: 3 -0.359679173651E+03 0.52297E-05 -0.20748E-05 47085 0.193E-02
288 F= -.35967917E+03 E0= -.35968313E+03 d E =-.375393E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359679156409E+03 0.22471E-04 -0.16117E-01 57726 0.133E+00 0.884E-02
DAV: 2 -0.359679430467E+03 -0.27406E-03 -0.34537E-03 66399 0.174E-01 0.569E-02
DAV: 3 -0.359679406811E+03 0.23656E-04 -0.95179E-05 70224 0.383E-02 0.318E-02
DAV: 4 -0.359679403835E+03 0.29756E-05 -0.40485E-05 60855 0.232E-02
289 F= -.35967940E+03 E0= -.35968336E+03 d E =-.605578E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359679405498E+03 0.13127E-05 -0.95239E-03 57822 0.324E-01 0.197E-02
DAV: 2 -0.359679421180E+03 -0.15682E-04 -0.20780E-04 65976 0.428E-02 0.134E-02
DAV: 3 -0.359679419397E+03 0.17833E-05 -0.49382E-06 31461 0.902E-03
290 F= -.35967942E+03 E0= -.35968337E+03 d E =-.621139E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359679611069E+03 -0.18989E-03 -0.44722E-02 57732 0.699E-01 0.441E-02
DAV: 2 -0.359679693472E+03 -0.82404E-04 -0.10141E-03 65310 0.935E-02 0.278E-02
DAV: 3 -0.359679687830E+03 0.56426E-05 -0.23600E-05 50379 0.186E-02
291 F= -.35967969E+03 E0= -.35968364E+03 d E =-.268433E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359679693195E+03 0.27779E-06 -0.80184E-02 57726 0.936E-01 0.629E-02
DAV: 2 -0.359679831148E+03 -0.13795E-03 -0.17328E-03 65985 0.122E-01 0.390E-02
DAV: 3 -0.359679822368E+03 0.87804E-05 -0.46377E-05 63987 0.251E-02
292 F= -.35967982E+03 E0= -.35968378E+03 d E =-.402971E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359680080268E+03 -0.24912E-03 -0.60703E-02 57726 0.815E-01 0.560E-02
DAV: 2 -0.359680174678E+03 -0.94411E-04 -0.12411E-03 66282 0.106E-01 0.336E-02
DAV: 3 -0.359680169875E+03 0.48034E-05 -0.32312E-05 56364 0.216E-02
293 F= -.35968017E+03 E0= -.35968413E+03 d E =-.347507E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359679938950E+03 0.23573E-03 -0.35087E-01 57720 0.196E+00 0.130E-01
DAV: 2 -0.359680511834E+03 -0.57288E-03 -0.73393E-03 66273 0.256E-01 0.784E-02
DAV: 3 -0.359680480049E+03 0.31785E-04 -0.18488E-04 70125 0.509E-02 0.452E-02
DAV: 4 -0.359680480924E+03 -0.87515E-06 -0.85905E-05 64023 0.354E-02
294 F= -.35968048E+03 E0= -.35968444E+03 d E =-.658556E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359680448487E+03 0.31561E-04 -0.18529E-02 57750 0.452E-01 0.269E-02
DAV: 2 -0.359680478602E+03 -0.30114E-04 -0.39269E-04 65661 0.591E-02 0.173E-02
DAV: 3 -0.359680476033E+03 0.25692E-05 -0.89552E-06 33864 0.115E-02
295 F= -.35968048E+03 E0= -.35968443E+03 d E =-.653665E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359680747854E+03 -0.26925E-03 -0.81085E-02 57726 0.947E-01 0.590E-02
DAV: 2 -0.359680895089E+03 -0.14724E-03 -0.17872E-03 66021 0.125E-01 0.364E-02
DAV: 3 -0.359680886463E+03 0.86255E-05 -0.36297E-05 62529 0.237E-02
296 F= -.35968089E+03 E0= -.35968484E+03 d E =-.410431E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359680759113E+03 0.13598E-03 -0.27047E-01 57720 0.173E+00 0.114E-01
DAV: 2 -0.359681216708E+03 -0.45759E-03 -0.56920E-03 66282 0.223E-01 0.692E-02
DAV: 3 -0.359681191585E+03 0.25123E-04 -0.13362E-04 70863 0.442E-02 0.397E-02
DAV: 4 -0.359681191353E+03 0.23211E-06 -0.61358E-05 63942 0.312E-02
297 F= -.35968119E+03 E0= -.35968515E+03 d E =-.715320E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359681393763E+03 -0.20218E-03 -0.62433E-02 57735 0.828E-01 0.536E-02
DAV: 2 -0.359681503937E+03 -0.11017E-03 -0.13201E-03 65985 0.106E-01 0.328E-02
DAV: 3 -0.359681497953E+03 0.59833E-05 -0.25353E-05 55029 0.217E-02
298 F= -.35968150E+03 E0= -.35968545E+03 d E =-.306600E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359680985885E+03 0.51805E-03 -0.55656E-01 57720 0.247E+00 0.156E-01
DAV: 2 -0.359681938416E+03 -0.95253E-03 -0.11545E-02 65886 0.314E-01 0.978E-02
DAV: 3 -0.359681881078E+03 0.57338E-04 -0.24529E-04 70944 0.626E-02 0.552E-02
DAV: 4 -0.359681878568E+03 0.25094E-05 -0.12458E-04 66039 0.438E-02 0.143E-02
DAV: 5 -0.359681879520E+03 -0.95175E-06 -0.20969E-05 47220 0.187E-02
299 F= -.35968188E+03 E0= -.35968583E+03 d E =-.688167E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359682106805E+03 -0.22824E-03 -0.10850E-01 57732 0.109E+00 0.679E-02
DAV: 2 -0.359682293984E+03 -0.18718E-03 -0.22289E-03 65004 0.138E-01 0.418E-02
DAV: 3 -0.359682284499E+03 0.94851E-05 -0.40742E-05 64725 0.262E-02
300 F= -.35968228E+03 E0= -.35968624E+03 d E =-.404979E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359681347156E+03 0.94683E-03 -0.97082E-01 57720 0.325E+00 0.203E-01
DAV: 2 -0.359682962796E+03 -0.16156E-02 -0.19520E-02 65067 0.408E-01 0.126E-01
DAV: 3 -0.359682871589E+03 0.91207E-04 -0.38381E-04 70296 0.778E-02 0.711E-02
DAV: 4 -0.359682872442E+03 -0.85211E-06 -0.20200E-04 66408 0.545E-02 0.172E-02
DAV: 5 -0.359682873496E+03 -0.10543E-05 -0.38259E-05 59280 0.251E-02
301 F= -.35968287E+03 E0= -.35968683E+03 d E =-.993976E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359683150709E+03 -0.27827E-03 -0.25018E-01 57720 0.164E+00 0.105E-01
DAV: 2 -0.359683589775E+03 -0.43907E-03 -0.52808E-03 64815 0.213E-01 0.646E-02
DAV: 3 -0.359683567505E+03 0.22270E-04 -0.10628E-04 70509 0.402E-02 0.371E-02
DAV: 4 -0.359683568182E+03 -0.67689E-06 -0.54614E-05 61953 0.286E-02
302 F= -.35968357E+03 E0= -.35968752E+03 d E =-.694686E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359683694266E+03 -0.12676E-03 -0.62313E-02 57744 0.820E-01 0.537E-02
DAV: 2 -0.359683804092E+03 -0.10983E-03 -0.13192E-03 65058 0.106E-01 0.328E-02
DAV: 3 -0.359683798543E+03 0.55489E-05 -0.25002E-05 55221 0.209E-02
303 F= -.35968380E+03 E0= -.35968775E+03 d E =-.925047E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359683638082E+03 0.16601E-03 -0.24565E-01 57720 0.163E+00 0.105E-01
DAV: 2 -0.359684049198E+03 -0.41112E-03 -0.50499E-03 65103 0.209E-01 0.650E-02
DAV: 3 -0.359684027641E+03 0.21557E-04 -0.10897E-04 70656 0.400E-02 0.372E-02
DAV: 4 -0.359684028750E+03 -0.11086E-05 -0.55557E-05 61818 0.290E-02
304 F= -.35968403E+03 E0= -.35968799E+03 d E =-.115525E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359684006348E+03 0.21293E-04 -0.37399E-01 57720 0.201E+00 0.131E-01
DAV: 2 -0.359684675195E+03 -0.66885E-03 -0.81250E-03 65886 0.264E-01 0.814E-02
DAV: 3 -0.359684638636E+03 0.36558E-04 -0.17924E-04 69846 0.510E-02 0.475E-02
DAV: 4 -0.359684637838E+03 0.79805E-06 -0.88371E-05 63222 0.357E-02
305 F= -.35968464E+03 E0= -.35968859E+03 d E =-.609088E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359684652240E+03 -0.13604E-04 -0.27640E-03 58824 0.172E-01 0.142E-02
DAV: 2 -0.359684657933E+03 -0.56925E-05 -0.65841E-05 64059 0.237E-02
306 F= -.35968466E+03 E0= -.35968861E+03 d E =-.629183E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359684665755E+03 -0.13514E-04 -0.10572E-02 57828 0.338E-01 0.254E-02
DAV: 2 -0.359684683046E+03 -0.17291E-04 -0.22253E-04 66300 0.436E-02 0.160E-02
DAV: 3 -0.359684682022E+03 0.10237E-05 -0.50202E-06 33129 0.904E-03
307 F= -.35968468E+03 E0= -.35968864E+03 d E =-.653272E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359684836394E+03 -0.15335E-03 -0.20877E-01 57720 0.150E+00 0.958E-02
DAV: 2 -0.359685183949E+03 -0.34755E-03 -0.42766E-03 66192 0.192E-01 0.587E-02
DAV: 3 -0.359685164724E+03 0.19224E-04 -0.92627E-05 69549 0.370E-02 0.334E-02
DAV: 4 -0.359685164990E+03 -0.26521E-06 -0.43972E-05 62340 0.252E-02
308 F= -.35968516E+03 E0= -.35968912E+03 d E =-.482968E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359685211748E+03 -0.47023E-04 -0.19754E-02 57786 0.461E-01 0.312E-02
DAV: 2 -0.359685246019E+03 -0.34271E-04 -0.41268E-04 66237 0.596E-02 0.186E-02
DAV: 3 -0.359685244392E+03 0.16270E-05 -0.74625E-06 38838 0.121E-02
309 F= -.35968524E+03 E0= -.35968920E+03 d E =-.562370E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359685187195E+03 0.58824E-04 -0.77523E-02 57720 0.915E-01 0.595E-02
DAV: 2 -0.359685313654E+03 -0.12646E-03 -0.15701E-03 66282 0.117E-01 0.362E-02
DAV: 3 -0.359685306945E+03 0.67089E-05 -0.33138E-05 57657 0.225E-02
310 F= -.35968531E+03 E0= -.35968927E+03 d E =-.624923E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359685458452E+03 -0.14480E-03 -0.16857E-01 57720 0.135E+00 0.855E-02
DAV: 2 -0.359685728428E+03 -0.26998E-03 -0.32734E-03 65247 0.167E-01 0.530E-02
DAV: 3 -0.359685714324E+03 0.14104E-04 -0.64503E-05 70545 0.328E-02 0.297E-02
DAV: 4 -0.359685715778E+03 -0.14540E-05 -0.37716E-05 61845 0.232E-02
311 F= -.35968572E+03 E0= -.35968967E+03 d E =-.408833E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359685796996E+03 -0.82672E-04 -0.37288E-02 57747 0.634E-01 0.407E-02
DAV: 2 -0.359685860784E+03 -0.63788E-04 -0.75469E-04 65067 0.802E-02 0.250E-02
DAV: 3 -0.359685857491E+03 0.32929E-05 -0.12464E-05 44733 0.162E-02
312 F= -.35968586E+03 E0= -.35968982E+03 d E =-.550546E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359685826494E+03 0.34290E-04 -0.14663E-01 57720 0.126E+00 0.791E-02
DAV: 2 -0.359686063434E+03 -0.23694E-03 -0.28623E-03 65130 0.156E-01 0.491E-02
DAV: 3 -0.359686051007E+03 0.12426E-04 -0.55251E-05 69396 0.304E-02 0.276E-02
DAV: 4 -0.359686051995E+03 -0.98766E-06 -0.32476E-05 57948 0.217E-02
313 F= -.35968605E+03 E0= -.35969001E+03 d E =-.745050E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359686343725E+03 -0.29272E-03 -0.13175E-01 57720 0.120E+00 0.782E-02
DAV: 2 -0.359686569059E+03 -0.22533E-03 -0.28516E-03 66003 0.158E-01 0.493E-02
DAV: 3 -0.359686551812E+03 0.17247E-04 -0.76236E-05 70728 0.334E-02 0.277E-02
DAV: 4 -0.359686549757E+03 0.20544E-05 -0.29309E-05 55968 0.211E-02
314 F= -.35968655E+03 E0= -.35969051E+03 d E =-.497762E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359686587125E+03 -0.35313E-04 -0.10399E-02 57852 0.336E-01 0.232E-02
DAV: 2 -0.359686605140E+03 -0.18016E-04 -0.22317E-04 66210 0.442E-02 0.141E-02
DAV: 3 -0.359686603965E+03 0.11752E-05 -0.49519E-06 36822 0.945E-03
315 F= -.35968660E+03 E0= -.35969056E+03 d E =-.551970E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359686535792E+03 0.69348E-04 -0.41090E-02 57720 0.668E-01 0.442E-02
DAV: 2 -0.359686603785E+03 -0.67993E-04 -0.87047E-04 66264 0.872E-02 0.279E-02
DAV: 3 -0.359686598368E+03 0.54170E-05 -0.22074E-05 49935 0.184E-02
316 F= -.35968660E+03 E0= -.35969056E+03 d E =-.546373E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359686600846E+03 0.29392E-05 -0.11518E-02 57726 0.354E-01 0.207E-02
DAV: 2 -0.359686622537E+03 -0.21691E-04 -0.27131E-04 64509 0.487E-02 0.137E-02
DAV: 3 -0.359686620610E+03 0.19271E-05 -0.55947E-06 31290 0.976E-03
317 F= -.35968662E+03 E0= -.35969058E+03 d E =-.568614E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359686765838E+03 -0.14330E-03 -0.12548E-01 57720 0.116E+00 0.725E-02
DAV: 2 -0.359686967683E+03 -0.20184E-03 -0.25590E-03 65940 0.150E-01 0.456E-02
DAV: 3 -0.359686953937E+03 0.13746E-04 -0.62220E-05 70899 0.305E-02 0.259E-02
DAV: 4 -0.359686952973E+03 0.96393E-06 -0.26391E-05 54798 0.195E-02
318 F= -.35968695E+03 E0= -.35969091E+03 d E =-.332364E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359686955257E+03 -0.13194E-05 -0.84530E-02 57720 0.953E-01 0.618E-02
DAV: 2 -0.359687090009E+03 -0.13475E-03 -0.17030E-03 66165 0.122E-01 0.383E-02
DAV: 3 -0.359687081443E+03 0.85659E-05 -0.40149E-05 63420 0.254E-02
319 F= -.35968708E+03 E0= -.35969104E+03 d E =-.460833E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359687372066E+03 -0.28206E-03 -0.56591E-02 57720 0.791E-01 0.551E-02
DAV: 2 -0.359687455188E+03 -0.83123E-04 -0.12010E-03 66741 0.105E-01 0.357E-02
DAV: 3 -0.359687445588E+03 0.96002E-05 -0.38174E-05 61746 0.241E-02
320 F= -.35968745E+03 E0= -.35969140E+03 d E =-.364145E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359687470407E+03 -0.15219E-04 -0.15072E-02 57804 0.408E-01 0.304E-02
DAV: 2 -0.359687490555E+03 -0.20148E-04 -0.30367E-04 67560 0.531E-02 0.193E-02
DAV: 3 -0.359687488213E+03 0.23419E-05 -0.94487E-06 38661 0.126E-02
321 F= -.35968749E+03 E0= -.35969145E+03 d E =-.406770E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359687648355E+03 -0.15780E-03 -0.68052E-02 57720 0.865E-01 0.585E-02
DAV: 2 -0.359687765373E+03 -0.11702E-03 -0.15122E-03 67335 0.115E-01 0.364E-02
DAV: 3 -0.359687756546E+03 0.88274E-05 -0.42359E-05 65841 0.244E-02
322 F= -.35968776E+03 E0= -.35969172E+03 d E =-.268332E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359687766468E+03 -0.10954E-05 -0.12094E-02 57804 0.364E-01 0.286E-02
DAV: 2 -0.359687784077E+03 -0.17608E-04 -0.24894E-04 68559 0.470E-02 0.175E-02
DAV: 3 -0.359687782632E+03 0.14449E-05 -0.75636E-06 38220 0.109E-02
323 F= -.35968778E+03 E0= -.35969174E+03 d E =-.294418E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359687982644E+03 -0.19857E-03 -0.73381E-02 57720 0.895E-01 0.603E-02
DAV: 2 -0.359688093877E+03 -0.11123E-03 -0.15221E-03 66327 0.118E-01 0.376E-02
DAV: 3 -0.359688083387E+03 0.10490E-04 -0.41677E-05 66156 0.257E-02 0.211E-02
DAV: 4 -0.359688082827E+03 0.56059E-06 -0.19972E-05 43278 0.172E-02
324 F= -.35968808E+03 E0= -.35969204E+03 d E =-.300195E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359688096558E+03 -0.13171E-04 -0.64378E-03 57804 0.265E-01 0.188E-02
DAV: 2 -0.359688107203E+03 -0.10645E-04 -0.13864E-04 66318 0.356E-02 0.114E-02
DAV: 3 -0.359688106400E+03 0.80321E-06 -0.31297E-06 35955 0.799E-03
325 F= -.35968811E+03 E0= -.35969207E+03 d E =-.323768E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359688298734E+03 -0.19153E-03 -0.52651E-02 57720 0.758E-01 0.506E-02
DAV: 2 -0.359688385351E+03 -0.86616E-04 -0.11230E-03 65832 0.998E-02 0.328E-02
DAV: 3 -0.359688377282E+03 0.80690E-05 -0.27413E-05 56535 0.221E-02
326 F= -.35968838E+03 E0= -.35969234E+03 d E =-.270882E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359688393195E+03 -0.78439E-05 -0.23703E-02 57720 0.508E-01 0.365E-02
DAV: 2 -0.359688428842E+03 -0.35648E-04 -0.47778E-04 66471 0.655E-02 0.232E-02
DAV: 3 -0.359688425636E+03 0.32065E-05 -0.11454E-05 41244 0.147E-02
327 F= -.35968843E+03 E0= -.35969239E+03 d E =-.319236E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359688573177E+03 -0.14433E-03 -0.22382E-02 57720 0.491E-01 0.341E-02
DAV: 2 -0.359688608577E+03 -0.35400E-04 -0.45845E-04 66102 0.633E-02 0.204E-02
DAV: 3 -0.359688606409E+03 0.21679E-05 -0.11860E-05 43923 0.133E-02
328 F= -.35968861E+03 E0= -.35969257E+03 d E =-.180773E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359688541895E+03 0.66682E-04 -0.17282E-01 57720 0.136E+00 0.918E-02
DAV: 2 -0.359688823503E+03 -0.28161E-03 -0.35865E-03 66012 0.177E-01 0.557E-02
DAV: 3 -0.359688804022E+03 0.19482E-04 -0.92128E-05 67938 0.362E-02 0.311E-02
DAV: 4 -0.359688803262E+03 0.75928E-06 -0.38223E-05 56976 0.240E-02
329 F= -.35968880E+03 E0= -.35969276E+03 d E =-.377627E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359688976752E+03 -0.17273E-03 -0.39089E-02 57720 0.649E-01 0.441E-02
DAV: 2 -0.359689039668E+03 -0.62915E-04 -0.80240E-04 65751 0.841E-02 0.267E-02
DAV: 3 -0.359689035604E+03 0.40637E-05 -0.17502E-05 48498 0.178E-02
330 F= -.35968904E+03 E0= -.35969300E+03 d E =-.232342E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359688763983E+03 0.27568E-03 -0.34809E-01 57720 0.194E+00 0.129E-01
DAV: 2 -0.359689301085E+03 -0.53710E-03 -0.69937E-03 65778 0.249E-01 0.792E-02
DAV: 3 -0.359689263227E+03 0.37858E-04 -0.17267E-04 68334 0.510E-02 0.441E-02
DAV: 4 -0.359689263626E+03 -0.39888E-06 -0.83811E-05 65085 0.339E-02
331 F= -.35968926E+03 E0= -.35969322E+03 d E =-.460364E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359689221586E+03 0.41642E-04 -0.34734E-02 57720 0.613E-01 0.384E-02
DAV: 2 -0.359689272744E+03 -0.51159E-04 -0.70024E-04 65076 0.790E-02 0.242E-02
DAV: 3 -0.359689268032E+03 0.47126E-05 -0.16916E-05 46392 0.157E-02
332 F= -.35968927E+03 E0= -.35969323E+03 d E =-.464769E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359689512686E+03 -0.23994E-03 -0.58988E-02 57720 0.802E-01 0.518E-02
DAV: 2 -0.359689617786E+03 -0.10510E-03 -0.13299E-03 65769 0.108E-01 0.338E-02
DAV: 3 -0.359689608289E+03 0.94970E-05 -0.29440E-05 55122 0.227E-02
333 F= -.35968961E+03 E0= -.35969357E+03 d E =-.340258E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359689618458E+03 -0.67176E-06 -0.90739E-02 57720 0.995E-01 0.696E-02
DAV: 2 -0.359689765645E+03 -0.14719E-03 -0.19242E-03 66129 0.130E-01 0.442E-02
DAV: 3 -0.359689753404E+03 0.12241E-04 -0.49719E-05 68289 0.284E-02 0.251E-02
DAV: 4 -0.359689752710E+03 0.69428E-06 -0.28153E-05 54474 0.192E-02
334 F= -.35968975E+03 E0= -.35969371E+03 d E =-.484678E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359689917972E+03 -0.16457E-03 -0.51942E-02 57720 0.751E-01 0.501E-02
DAV: 2 -0.359690003021E+03 -0.85049E-04 -0.10765E-03 66039 0.973E-02 0.305E-02
DAV: 3 -0.359689997720E+03 0.53018E-05 -0.24996E-05 51603 0.203E-02
335 F= -.35969000E+03 E0= -.35969396E+03 d E =-.245010E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359689830914E+03 0.17211E-03 -0.23063E-01 57720 0.158E+00 0.106E-01
DAV: 2 -0.359690191243E+03 -0.36033E-03 -0.46586E-03 66084 0.203E-01 0.647E-02
DAV: 3 -0.359690167706E+03 0.23537E-04 -0.12157E-04 68604 0.418E-02 0.354E-02
DAV: 4 -0.359690168643E+03 -0.93642E-06 -0.48264E-05 64797 0.259E-02
336 F= -.35969017E+03 E0= -.35969413E+03 d E =-.415933E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359690146206E+03 0.21500E-04 -0.16968E-02 57720 0.430E-01 0.265E-02
DAV: 2 -0.359690171790E+03 -0.25583E-04 -0.34770E-04 65283 0.555E-02 0.170E-02
DAV: 3 -0.359690169379E+03 0.24109E-05 -0.84617E-06 34215 0.111E-02
337 F= -.35969017E+03 E0= -.35969413E+03 d E =-.416669E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359690380103E+03 -0.20831E-03 -0.36089E-02 57720 0.628E-01 0.398E-02
DAV: 2 -0.359690440811E+03 -0.60707E-04 -0.78030E-04 65805 0.835E-02 0.252E-02
DAV: 3 -0.359690435393E+03 0.54176E-05 -0.19169E-05 47571 0.172E-02
338 F= -.35969044E+03 E0= -.35969440E+03 d E =-.266014E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359690470459E+03 -0.29648E-04 -0.80241E-02 57720 0.937E-01 0.631E-02
DAV: 2 -0.359690595409E+03 -0.12495E-03 -0.16416E-03 66228 0.121E-01 0.394E-02
DAV: 3 -0.359690585006E+03 0.10404E-04 -0.47795E-05 65895 0.259E-02 0.216E-02
DAV: 4 -0.359690584212E+03 0.79341E-06 -0.15712E-05 41109 0.159E-02
339 F= -.35969058E+03 E0= -.35969455E+03 d E =-.414833E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359690746582E+03 -0.16158E-03 -0.34695E-02 57720 0.615E-01 0.409E-02
DAV: 2 -0.359690805524E+03 -0.58942E-04 -0.74500E-04 65760 0.814E-02 0.260E-02
DAV: 3 -0.359690800697E+03 0.48275E-05 -0.16710E-05 46266 0.174E-02
340 F= -.35969080E+03 E0= -.35969476E+03 d E =-.216485E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359690746823E+03 0.58702E-04 -0.13113E-01 57720 0.120E+00 0.799E-02
DAV: 2 -0.359690957583E+03 -0.21076E-03 -0.27305E-03 65832 0.156E-01 0.508E-02
DAV: 3 -0.359690939767E+03 0.17816E-04 -0.69786E-05 70161 0.331E-02 0.289E-02
DAV: 4 -0.359690937873E+03 0.18947E-05 -0.37420E-05 59577 0.223E-02
341 F= -.35969094E+03 E0= -.35969490E+03 d E =-.353660E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359691094353E+03 -0.15459E-03 -0.49625E-02 57720 0.731E-01 0.485E-02
DAV: 2 -0.359691171803E+03 -0.77451E-04 -0.99013E-04 64680 0.940E-02 0.293E-02
DAV: 3 -0.359691166506E+03 0.52976E-05 -0.21901E-05 51108 0.192E-02
342 F= -.35969117E+03 E0= -.35969513E+03 d E =-.228633E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359690792787E+03 0.37902E-03 -0.44265E-01 57720 0.218E+00 0.143E-01
DAV: 2 -0.359691459543E+03 -0.66676E-03 -0.86734E-03 64527 0.278E-01 0.872E-02
DAV: 3 -0.359691410084E+03 0.49459E-04 -0.21453E-04 68334 0.556E-02 0.470E-02
DAV: 4 -0.359691409978E+03 0.10588E-06 -0.90183E-05 66192 0.347E-02
343 F= -.35969141E+03 E0= -.35969537E+03 d E =-.472106E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359691348515E+03 0.61569E-04 -0.43636E-02 57720 0.687E-01 0.424E-02
DAV: 2 -0.359691412185E+03 -0.63671E-04 -0.86505E-04 64086 0.883E-02 0.267E-02
DAV: 3 -0.359691406082E+03 0.61034E-05 -0.21045E-05 49929 0.172E-02
344 F= -.35969141E+03 E0= -.35969537E+03 d E =-.468209E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359691693391E+03 -0.28121E-03 -0.91011E-02 57720 0.998E-01 0.631E-02
DAV: 2 -0.359691852772E+03 -0.15938E-03 -0.20157E-03 65472 0.134E-01 0.399E-02
DAV: 3 -0.359691839505E+03 0.13267E-04 -0.48106E-05 64230 0.263E-02 0.222E-02
DAV: 4 -0.359691837408E+03 0.20974E-05 -0.21086E-05 44376 0.179E-02
345 F= -.35969184E+03 E0= -.35969580E+03 d E =-.431326E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359691873150E+03 -0.33645E-04 -0.79153E-02 57720 0.930E-01 0.616E-02
DAV: 2 -0.359692008986E+03 -0.13584E-03 -0.17114E-03 65661 0.123E-01 0.382E-02
DAV: 3 -0.359691998872E+03 0.10114E-04 -0.41680E-05 62025 0.248E-02 0.211E-02
DAV: 4 -0.359691998007E+03 0.86484E-06 -0.19158E-05 43620 0.171E-02
346 F= -.35969200E+03 E0= -.35969596E+03 d E =-.591925E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359692191352E+03 -0.19248E-03 -0.11411E-01 57720 0.112E+00 0.741E-02
DAV: 2 -0.359692386264E+03 -0.19491E-03 -0.24402E-03 66066 0.147E-01 0.470E-02
DAV: 3 -0.359692370142E+03 0.16123E-04 -0.58030E-05 70134 0.317E-02 0.269E-02
DAV: 4 -0.359692368802E+03 0.13397E-05 -0.34421E-05 60297 0.210E-02
347 F= -.35969237E+03 E0= -.35969633E+03 d E =-.370795E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359692385221E+03 -0.15079E-04 -0.33615E-02 57720 0.607E-01 0.413E-02
DAV: 2 -0.359692443900E+03 -0.58679E-04 -0.72515E-04 66066 0.802E-02 0.260E-02
DAV: 3 -0.359692439077E+03 0.48231E-05 -0.14841E-05 43620 0.176E-02
348 F= -.35969244E+03 E0= -.35969640E+03 d E =-.441070E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359692629398E+03 -0.18550E-03 -0.82651E-02 57720 0.949E-01 0.633E-02
DAV: 2 -0.359692751044E+03 -0.12165E-03 -0.16243E-03 65625 0.121E-01 0.388E-02
DAV: 3 -0.359692740554E+03 0.10490E-04 -0.42629E-05 65049 0.252E-02 0.205E-02
DAV: 4 -0.359692740360E+03 0.19451E-06 -0.17801E-05 40884 0.160E-02
349 F= -.35969274E+03 E0= -.35969670E+03 d E =-.301283E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359692763874E+03 -0.23319E-04 -0.35721E-02 57720 0.623E-01 0.412E-02
DAV: 2 -0.359692820402E+03 -0.56528E-04 -0.72546E-04 65454 0.808E-02 0.252E-02
DAV: 3 -0.359692815735E+03 0.46667E-05 -0.16142E-05 46806 0.169E-02
350 F= -.35969282E+03 E0= -.35969678E+03 d E =-.376658E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359693023322E+03 -0.20292E-03 -0.66705E-02 57720 0.849E-01 0.569E-02
DAV: 2 -0.359693126443E+03 -0.10312E-03 -0.13320E-03 64941 0.109E-01 0.349E-02
DAV: 3 -0.359693118604E+03 0.78388E-05 -0.36011E-05 58344 0.227E-02
351 F= -.35969312E+03 E0= -.35969708E+03 d E =-.302869E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359692967180E+03 0.15926E-03 -0.28877E-01 57720 0.177E+00 0.118E-01
DAV: 2 -0.359693416602E+03 -0.44942E-03 -0.57871E-03 64797 0.227E-01 0.726E-02
DAV: 3 -0.359693380976E+03 0.35625E-04 -0.15848E-04 67524 0.469E-02 0.386E-02
DAV: 4 -0.359693379624E+03 0.13521E-05 -0.56121E-05 65769 0.284E-02
352 F= -.35969338E+03 E0= -.35969734E+03 d E =-.563889E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359693530947E+03 -0.14997E-03 -0.33575E-02 57720 0.601E-01 0.408E-02
DAV: 2 -0.359693582980E+03 -0.52032E-04 -0.66207E-04 64797 0.770E-02 0.249E-02
DAV: 3 -0.359693579341E+03 0.36392E-05 -0.14005E-05 44025 0.165E-02
353 F= -.35969358E+03 E0= -.35969754E+03 d E =-.199716E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359693553524E+03 0.29455E-04 -0.29865E-01 57720 0.179E+00 0.118E-01
DAV: 2 -0.359693991814E+03 -0.43829E-03 -0.57864E-03 64626 0.228E-01 0.730E-02
DAV: 3 -0.359693956091E+03 0.35723E-04 -0.14461E-04 69045 0.471E-02 0.391E-02
DAV: 4 -0.359693955966E+03 0.12429E-06 -0.66640E-05 64968 0.291E-02
354 F= -.35969396E+03 E0= -.35969792E+03 d E =-.576342E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359693971275E+03 -0.15184E-04 -0.14740E-02 57750 0.398E-01 0.278E-02
DAV: 2 -0.359693995235E+03 -0.23960E-04 -0.29676E-04 64986 0.514E-02 0.170E-02
DAV: 3 -0.359693993686E+03 0.15493E-05 -0.61177E-06 37176 0.115E-02
355 F= -.35969399E+03 E0= -.35969796E+03 d E =-.614062E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359693944150E+03 0.51085E-04 -0.57495E-02 57720 0.786E-01 0.526E-02
DAV: 2 -0.359694027518E+03 -0.83368E-04 -0.11085E-03 65148 0.100E-01 0.323E-02
DAV: 3 -0.359694020861E+03 0.66571E-05 -0.26467E-05 55176 0.207E-02
356 F= -.35969402E+03 E0= -.35969798E+03 d E =-.641236E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359694258635E+03 -0.23112E-03 -0.10266E-01 57720 0.105E+00 0.703E-02
DAV: 2 -0.359694406250E+03 -0.14761E-03 -0.19506E-03 64662 0.132E-01 0.431E-02
DAV: 3 -0.359694395505E+03 0.10744E-04 -0.47334E-05 63960 0.273E-02 0.231E-02
DAV: 4 -0.359694396203E+03 -0.69715E-06 -0.23231E-05 48228 0.177E-02
357 F= -.35969440E+03 E0= -.35969836E+03 d E =-.375342E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359693833865E+03 0.56164E-03 -0.93304E-01 57720 0.316E+00 0.206E-01
DAV: 2 -0.359695241440E+03 -0.14076E-02 -0.18255E-02 64401 0.403E-01 0.128E-01
DAV: 3 -0.359695127778E+03 0.11366E-03 -0.42616E-04 68442 0.824E-02 0.688E-02
DAV: 4 -0.359695126670E+03 0.11079E-05 -0.21049E-04 65337 0.516E-02 0.179E-02
DAV: 5 -0.359695127158E+03 -0.48839E-06 -0.38753E-05 59163 0.255E-02
358 F= -.35969513E+03 E0= -.35969909E+03 d E =-.110630E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359689669632E+03 0.54570E-02 -0.37268E+00 57720 0.633E+00 0.412E-01
DAV: 2 -0.359695287717E+03 -0.56181E-02 -0.72757E-02 64275 0.806E-01 0.254E-01
DAV: 3 -0.359694827455E+03 0.46026E-03 -0.16974E-03 68361 0.163E-01 0.137E-01
DAV: 4 -0.359694814101E+03 0.13354E-04 -0.82384E-04 65022 0.102E-01 0.352E-02
DAV: 5 -0.359694816395E+03 -0.22935E-05 -0.15409E-04 70998 0.500E-02 0.163E-02
DAV: 6 -0.359694816574E+03 -0.17931E-06 -0.16360E-05 46788 0.138E-02
359 F= -.35969482E+03 E0= -.35969878E+03 d E =-.795713E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359693189207E+03 0.16272E-02 -0.15421E+00 57720 0.407E+00 0.263E-01
DAV: 2 -0.359695483363E+03 -0.22942E-02 -0.29971E-02 64320 0.517E-01 0.164E-01
DAV: 3 -0.359695289037E+03 0.19433E-03 -0.70803E-04 68352 0.106E-01 0.879E-02
DAV: 4 -0.359695284087E+03 0.49500E-05 -0.34588E-04 65094 0.659E-02 0.227E-02
DAV: 5 -0.359695284911E+03 -0.82417E-06 -0.64447E-05 68784 0.325E-02
360 F= -.35969528E+03 E0= -.35969925E+03 d E =-.126405E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359695545934E+03 -0.26185E-03 -0.92035E-02 57720 0.994E-01 0.624E-02
DAV: 2 -0.359695678674E+03 -0.13274E-03 -0.17923E-03 63564 0.126E-01 0.394E-02
DAV: 3 -0.359695665229E+03 0.13445E-04 -0.42172E-05 59973 0.257E-02 0.211E-02
DAV: 4 -0.359695664202E+03 0.10269E-05 -0.22840E-05 43992 0.176E-02
361 F= -.35969566E+03 E0= -.35969963E+03 d E =-.379291E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359695371661E+03 0.29357E-03 -0.82921E-01 57720 0.298E+00 0.194E-01
DAV: 2 -0.359696629365E+03 -0.12577E-02 -0.16216E-02 64149 0.379E-01 0.119E-01
DAV: 3 -0.359696528872E+03 0.10049E-03 -0.37360E-04 67803 0.755E-02 0.633E-02
DAV: 4 -0.359696528189E+03 0.68283E-06 -0.17915E-04 66318 0.483E-02 0.157E-02
DAV: 5 -0.359696528466E+03 -0.27637E-06 -0.33123E-05 57534 0.231E-02
362 F= -.35969653E+03 E0= -.35970049E+03 d E =-.124355E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359692377721E+03 0.41505E-02 -0.33126E+00 57720 0.597E+00 0.386E-01
DAV: 2 -0.359697421324E+03 -0.50436E-02 -0.64809E-02 63978 0.758E-01 0.238E-01
DAV: 3 -0.359697012091E+03 0.40923E-03 -0.14925E-03 67722 0.150E-01 0.126E-01
DAV: 4 -0.359696999880E+03 0.12211E-04 -0.70956E-04 66093 0.962E-02 0.311E-02
DAV: 5 -0.359697001569E+03 -0.16893E-05 -0.13438E-04 70935 0.457E-02 0.153E-02
DAV: 6 -0.359697001615E+03 -0.45691E-07 -0.12953E-05 43503 0.124E-02
363 F= -.35969700E+03 E0= -.35970097E+03 d E =-.171670E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359696759884E+03 0.24169E-03 -0.20589E-01 57720 0.149E+00 0.951E-02
DAV: 2 -0.359697067218E+03 -0.30733E-03 -0.40068E-03 63750 0.188E-01 0.593E-02
DAV: 3 -0.359697042172E+03 0.25046E-04 -0.93100E-05 67677 0.376E-02 0.315E-02
DAV: 4 -0.359697041574E+03 0.59753E-06 -0.44050E-05 62862 0.239E-02
364 F= -.35969704E+03 E0= -.35970101E+03 d E =-.175666E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359697157382E+03 -0.11521E-03 -0.50619E-01 57720 0.233E+00 0.148E-01
DAV: 2 -0.359697906637E+03 -0.74925E-03 -0.97656E-03 64059 0.294E-01 0.921E-02
DAV: 3 -0.359697842854E+03 0.63782E-04 -0.21801E-04 67911 0.582E-02 0.485E-02
DAV: 4 -0.359697841781E+03 0.10733E-05 -0.10966E-04 67362 0.374E-02 0.117E-02
DAV: 5 -0.359697841845E+03 -0.64420E-07 -0.18814E-05 47067 0.179E-02
365 F= -.35969784E+03 E0= -.35970181E+03 d E =-.800271E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359696443432E+03 0.13983E-02 -0.16401E+00 57720 0.420E+00 0.270E-01
DAV: 2 -0.359698918208E+03 -0.24748E-02 -0.31726E-02 64104 0.530E-01 0.167E-01
DAV: 3 -0.359698716990E+03 0.20122E-03 -0.69978E-04 67785 0.106E-01 0.882E-02
DAV: 4 -0.359698715454E+03 0.15364E-05 -0.35102E-04 66921 0.668E-02 0.214E-02
DAV: 5 -0.359698715921E+03 -0.46650E-06 -0.63858E-05 66651 0.320E-02
366 F= -.35969872E+03 E0= -.35970268E+03 d E =-.167435E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359689170724E+03 0.95447E-02 -0.65577E+00 57720 0.839E+00 0.542E-01
DAV: 2 -0.359699125782E+03 -0.99551E-02 -0.12726E-01 64005 0.106E+00 0.334E-01
DAV: 3 -0.359698308769E+03 0.81701E-03 -0.28066E-03 67668 0.211E-01 0.178E-01
DAV: 4 -0.359698282386E+03 0.26383E-04 -0.14067E-03 66318 0.134E-01 0.430E-02
DAV: 5 -0.359698285243E+03 -0.28561E-05 -0.25980E-04 69846 0.639E-02 0.210E-02
DAV: 6 -0.359698285935E+03 -0.69254E-06 -0.27056E-05 56778 0.175E-02
367 F= -.35969829E+03 E0= -.35970225E+03 d E =-.124436E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359694905938E+03 0.33793E-02 -0.29098E+00 57720 0.559E+00 0.358E-01
DAV: 2 -0.359699271055E+03 -0.43651E-02 -0.56201E-02 63933 0.705E-01 0.222E-01
DAV: 3 -0.359698899964E+03 0.37109E-03 -0.12502E-03 67704 0.141E-01 0.118E-01
DAV: 4 -0.359698893869E+03 0.60951E-05 -0.63078E-04 66309 0.895E-02 0.287E-02
DAV: 5 -0.359698895158E+03 -0.12893E-05 -0.11505E-04 69531 0.429E-02 0.140E-02
DAV: 6 -0.359698895438E+03 -0.27960E-06 -0.11573E-05 42342 0.117E-02
368 F= -.35969890E+03 E0= -.35970286E+03 d E =-.185386E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359698711680E+03 0.18348E-03 -0.88837E-01 57720 0.309E+00 0.198E-01
DAV: 2 -0.359700049142E+03 -0.13375E-02 -0.17262E-02 63663 0.390E-01 0.124E-01
DAV: 3 -0.359699936100E+03 0.11304E-03 -0.38159E-04 67659 0.787E-02 0.663E-02
DAV: 4 -0.359699932833E+03 0.32663E-05 -0.19947E-04 66894 0.501E-02 0.164E-02
DAV: 5 -0.359699933141E+03 -0.30746E-06 -0.37359E-05 58902 0.249E-02
369 F= -.35969993E+03 E0= -.35970390E+03 d E =-.103770E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359694120645E+03 0.58122E-02 -0.49751E+00 57720 0.730E+00 0.473E-01
DAV: 2 -0.359701717872E+03 -0.75972E-02 -0.97165E-02 63726 0.925E-01 0.293E-01
DAV: 3 -0.359701090968E+03 0.62690E-03 -0.21243E-03 67641 0.185E-01 0.158E-01
DAV: 4 -0.359701062033E+03 0.28935E-04 -0.11018E-03 65769 0.118E-01 0.388E-02
DAV: 5 -0.359701064137E+03 -0.21042E-05 -0.21141E-04 69594 0.584E-02 0.187E-02
DAV: 6 -0.359701064822E+03 -0.68542E-06 -0.22571E-05 52755 0.160E-02
370 F= -.35970106E+03 E0= -.35970503E+03 d E =-.216938E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359700138890E+03 0.92525E-03 -0.16776E+00 57720 0.424E+00 0.277E-01
DAV: 2 -0.359702695242E+03 -0.25564E-02 -0.32988E-02 63942 0.540E-01 0.169E-01
DAV: 3 -0.359702492136E+03 0.20311E-03 -0.77567E-04 67092 0.106E-01 0.900E-02
DAV: 4 -0.359702486737E+03 0.53989E-05 -0.33321E-04 66309 0.664E-02 0.224E-02
DAV: 5 -0.359702488913E+03 -0.21764E-05 -0.65524E-05 68946 0.309E-02
371 F= -.35970249E+03 E0= -.35970646E+03 d E =-.142409E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359698504909E+03 0.39818E-02 -0.33302E+00 57720 0.597E+00 0.390E-01
DAV: 2 -0.359703609957E+03 -0.51050E-02 -0.65430E-02 63870 0.759E-01 0.239E-01
DAV: 3 -0.359703211882E+03 0.39807E-03 -0.15267E-03 67119 0.148E-01 0.127E-01
DAV: 4 -0.359703198530E+03 0.13352E-04 -0.64963E-04 65994 0.925E-02 0.314E-02
DAV: 5 -0.359703203052E+03 -0.45219E-05 -0.12748E-04 69675 0.430E-02 0.147E-02
DAV: 6 -0.359703202784E+03 0.26737E-06 -0.10791E-05 42684 0.114E-02
372 F= -.35970320E+03 E0= -.35970717E+03 d E =-.213796E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359701680740E+03 0.15223E-02 -0.21283E+00 57720 0.477E+00 0.312E-01
DAV: 2 -0.359704888823E+03 -0.32081E-02 -0.41667E-02 63717 0.608E-01 0.191E-01
DAV: 3 -0.359704632206E+03 0.25662E-03 -0.97150E-04 67299 0.120E-01 0.102E-01
DAV: 4 -0.359704627792E+03 0.44144E-05 -0.43885E-04 65589 0.750E-02 0.258E-02
DAV: 5 -0.359704629587E+03 -0.17953E-05 -0.83241E-05 70134 0.358E-02
373 F= -.35970463E+03 E0= -.35970860E+03 d E =-.142680E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359692222304E+03 0.12405E-01 -0.97030E+00 57720 0.102E+01 0.669E-01
DAV: 2 -0.359706997725E+03 -0.14775E-01 -0.19050E-01 63690 0.130E+00 0.409E-01
DAV: 3 -0.359705836865E+03 0.11609E-02 -0.44255E-03 67362 0.255E-01 0.220E-01
DAV: 4 -0.359705784919E+03 0.51946E-04 -0.19705E-03 65121 0.159E-01 0.555E-02
DAV: 5 -0.359705795222E+03 -0.10303E-04 -0.37442E-04 70170 0.754E-02 0.252E-02
DAV: 6 -0.359705794953E+03 0.26898E-06 -0.36721E-05 59613 0.204E-02
374 F= -.35970579E+03 E0= -.35970976E+03 d E =-.259217E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359703697684E+03 0.20975E-02 -0.27210E+00 57720 0.541E+00 0.352E-01
DAV: 2 -0.359707840989E+03 -0.41433E-02 -0.53275E-02 63483 0.685E-01 0.218E-01
DAV: 3 -0.359707503102E+03 0.33789E-03 -0.11622E-03 67686 0.137E-01 0.117E-01
DAV: 4 -0.359707494278E+03 0.88241E-05 -0.61416E-04 65769 0.887E-02 0.291E-02
DAV: 5 -0.359707494781E+03 -0.50222E-06 -0.11778E-04 70134 0.437E-02 0.139E-02
DAV: 6 -0.359707494947E+03 -0.16631E-06 -0.12176E-05 43656 0.120E-02
375 F= -.35970749E+03 E0= -.35971146E+03 d E =-.169999E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359704656708E+03 0.28381E-02 -0.27461E+00 57720 0.543E+00 0.353E-01
DAV: 2 -0.359708816935E+03 -0.41602E-02 -0.53569E-02 63348 0.687E-01 0.219E-01
DAV: 3 -0.359708474191E+03 0.34274E-03 -0.11715E-03 67686 0.138E-01 0.118E-01
DAV: 4 -0.359708464581E+03 0.96096E-05 -0.61913E-04 65832 0.889E-02 0.292E-02
DAV: 5 -0.359708465071E+03 -0.49014E-06 -0.11809E-04 70044 0.438E-02 0.140E-02
DAV: 6 -0.359708465265E+03 -0.19392E-06 -0.12318E-05 43503 0.121E-02
376 F= -.35970847E+03 E0= -.35971244E+03 d E =-.267031E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359692925228E+03 0.15540E-01 -0.10976E+01 57720 0.108E+01 0.709E-01
DAV: 2 -0.359709612410E+03 -0.16687E-01 -0.21448E-01 63285 0.138E+00 0.438E-01
DAV: 3 -0.359708236171E+03 0.13762E-02 -0.47026E-03 67686 0.274E-01 0.237E-01
DAV: 4 -0.359708160017E+03 0.76154E-04 -0.24445E-03 65571 0.177E-01 0.588E-02
DAV: 5 -0.359708165055E+03 -0.50380E-05 -0.46416E-04 70323 0.860E-02 0.278E-02
DAV: 6 -0.359708165916E+03 -0.86076E-06 -0.50931E-05 64518 0.237E-02
377 F= -.35970817E+03 E0= -.35971214E+03 d E =-.237096E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359702762000E+03 0.54031E-02 -0.43427E+00 57720 0.682E+00 0.442E-01
DAV: 2 -0.359709264700E+03 -0.65027E-02 -0.83921E-02 63003 0.860E-01 0.275E-01
DAV: 3 -0.359708709973E+03 0.55473E-03 -0.18605E-03 67650 0.174E-01 0.147E-01
DAV: 4 -0.359708699078E+03 0.10896E-04 -0.97805E-04 65400 0.111E-01 0.366E-02
DAV: 5 -0.359708699650E+03 -0.57240E-06 -0.18476E-04 70017 0.550E-02 0.174E-02
DAV: 6 -0.359708700101E+03 -0.45105E-06 -0.20275E-05 51909 0.152E-02
378 F= -.35970870E+03 E0= -.35971267E+03 d E =-.290515E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359706680726E+03 0.20189E-02 -0.30124E+00 57720 0.569E+00 0.367E-01
DAV: 2 -0.359711175375E+03 -0.44946E-02 -0.57812E-02 63339 0.714E-01 0.226E-01
DAV: 3 -0.359710803753E+03 0.37162E-03 -0.12782E-03 67236 0.142E-01 0.119E-01
DAV: 4 -0.359710797095E+03 0.66574E-05 -0.63090E-04 66354 0.898E-02 0.291E-02
DAV: 5 -0.359710797999E+03 -0.90408E-06 -0.11364E-04 69594 0.422E-02 0.141E-02
DAV: 6 -0.359710798158E+03 -0.15845E-06 -0.11388E-05 42207 0.117E-02
379 F= -.35971080E+03 E0= -.35971477E+03 d E =-.209806E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359688648055E+03 0.22150E-01 -0.17658E+01 57720 0.138E+01 0.900E-01
DAV: 2 -0.359715480026E+03 -0.26832E-01 -0.34319E-01 63528 0.174E+00 0.550E-01
DAV: 3 -0.359713290980E+03 0.21890E-02 -0.75615E-03 67560 0.343E-01 0.296E-01
DAV: 4 -0.359713176787E+03 0.11419E-03 -0.37078E-03 65706 0.219E-01 0.717E-02
DAV: 5 -0.359713189334E+03 -0.12547E-04 -0.67859E-04 69999 0.102E-01 0.345E-02
DAV: 6 -0.359713190385E+03 -0.10503E-05 -0.72404E-05 65040 0.281E-02
380 F= -.35971319E+03 E0= -.35971716E+03 d E =-.449028E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359711327958E+03 0.18614E-02 -0.28556E+00 57720 0.553E+00 0.360E-01
DAV: 2 -0.359715616848E+03 -0.42889E-02 -0.55318E-02 63582 0.698E-01 0.222E-01
DAV: 3 -0.359715262725E+03 0.35412E-03 -0.12425E-03 67389 0.138E-01 0.117E-01
DAV: 4 -0.359715254928E+03 0.77975E-05 -0.58957E-04 65985 0.872E-02 0.284E-02
DAV: 5 -0.359715256307E+03 -0.13786E-05 -0.10623E-04 69675 0.404E-02 0.137E-02
DAV: 6 -0.359715256317E+03 -0.10919E-07 -0.10582E-05 42189 0.112E-02
381 F= -.35971526E+03 E0= -.35971923E+03 d E =-.206593E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359712441057E+03 0.28152E-02 -0.28472E+00 57720 0.552E+00 0.358E-01
DAV: 2 -0.359716708752E+03 -0.42677E-02 -0.55116E-02 63429 0.696E-01 0.221E-01
DAV: 3 -0.359716349512E+03 0.35924E-03 -0.12379E-03 67380 0.138E-01 0.117E-01
DAV: 4 -0.359716339897E+03 0.96150E-05 -0.59091E-04 65904 0.871E-02 0.284E-02
DAV: 5 -0.359716341416E+03 -0.15182E-05 -0.10653E-04 69549 0.405E-02 0.137E-02
DAV: 6 -0.359716341466E+03 -0.50513E-07 -0.10563E-05 41964 0.113E-02
382 F= -.35971634E+03 E0= -.35972031E+03 d E =-.315108E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359699925373E+03 0.16416E-01 -0.11385E+01 57720 0.110E+01 0.719E-01
DAV: 2 -0.359717148661E+03 -0.17223E-01 -0.22166E-01 63375 0.140E+00 0.443E-01
DAV: 3 -0.359715691429E+03 0.14572E-02 -0.49713E-03 67515 0.277E-01 0.237E-01
DAV: 4 -0.359715611419E+03 0.80010E-04 -0.23747E-03 65130 0.175E-01 0.575E-02
DAV: 5 -0.359715620489E+03 -0.90703E-05 -0.43083E-04 69576 0.807E-02 0.276E-02
DAV: 6 -0.359715621003E+03 -0.51434E-06 -0.45914E-05 64743 0.226E-02
383 F= -.35971562E+03 E0= -.35971959E+03 d E =-.243062E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359708574198E+03 0.70463E-02 -0.57796E+00 57720 0.787E+00 0.508E-01
DAV: 2 -0.359717290947E+03 -0.87167E-02 -0.11248E-01 63222 0.993E-01 0.316E-01
DAV: 3 -0.359716544769E+03 0.74618E-03 -0.25196E-03 67308 0.197E-01 0.168E-01
DAV: 4 -0.359716527052E+03 0.17716E-04 -0.12093E-03 64626 0.125E-01 0.409E-02
DAV: 5 -0.359716531061E+03 -0.40086E-05 -0.21868E-04 69333 0.582E-02 0.195E-02
DAV: 6 -0.359716531292E+03 -0.23087E-06 -0.22559E-05 52143 0.161E-02
384 F= -.35971653E+03 E0= -.35972050E+03 d E =-.334091E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359714889289E+03 0.16418E-02 -0.25508E+00 57720 0.522E+00 0.339E-01
DAV: 2 -0.359718670119E+03 -0.37808E-02 -0.49154E-02 63078 0.657E-01 0.212E-01
DAV: 3 -0.359718342371E+03 0.32775E-03 -0.10902E-03 67965 0.132E-01 0.113E-01
DAV: 4 -0.359718331637E+03 0.10734E-04 -0.55923E-04 65913 0.847E-02 0.279E-02
DAV: 5 -0.359718332717E+03 -0.10804E-05 -0.10300E-04 68874 0.403E-02 0.132E-02
DAV: 6 -0.359718332899E+03 -0.18221E-06 -0.10844E-05 41334 0.113E-02
385 F= -.35971833E+03 E0= -.35972230E+03 d E =-.180161E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359705645151E+03 0.12688E-01 -0.10514E+01 57720 0.106E+01 0.693E-01
DAV: 2 -0.359721414667E+03 -0.15770E-01 -0.20402E-01 63285 0.134E+00 0.430E-01
DAV: 3 -0.359720071765E+03 0.13429E-02 -0.44993E-03 68055 0.266E-01 0.231E-01
DAV: 4 -0.359719993171E+03 0.78593E-04 -0.22972E-03 65571 0.172E-01 0.569E-02
DAV: 5 -0.359719998853E+03 -0.56814E-05 -0.42238E-04 69162 0.811E-02 0.269E-02
DAV: 6 -0.359719999634E+03 -0.78108E-06 -0.47890E-05 64473 0.228E-02
386 F= -.35972000E+03 E0= -.35972397E+03 d E =-.346834E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359716454356E+03 0.35445E-02 -0.47867E+00 57720 0.714E+00 0.470E-01
DAV: 2 -0.359723514605E+03 -0.70602E-02 -0.92129E-02 63726 0.903E-01 0.289E-01
DAV: 3 -0.359722927170E+03 0.58743E-03 -0.21195E-03 67857 0.178E-01 0.154E-01
DAV: 4 -0.359722910520E+03 0.16650E-04 -0.99203E-04 65886 0.114E-01 0.381E-02
DAV: 5 -0.359722913373E+03 -0.28530E-05 -0.18173E-04 69711 0.532E-02 0.175E-02
DAV: 6 -0.359722913337E+03 0.36249E-07 -0.19178E-05 50262 0.147E-02
387 F= -.35972291E+03 E0= -.35972689E+03 d E =-.291370E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359716853822E+03 0.60596E-02 -0.59169E+00 57720 0.794E+00 0.523E-01
DAV: 2 -0.359725570437E+03 -0.87166E-02 -0.11381E-01 63690 0.100E+00 0.321E-01
DAV: 3 -0.359724840997E+03 0.72944E-03 -0.26201E-03 67884 0.198E-01 0.171E-01
DAV: 4 -0.359724815842E+03 0.25155E-04 -0.12262E-03 65787 0.126E-01 0.425E-02
DAV: 5 -0.359724819595E+03 -0.37535E-05 -0.22407E-04 69702 0.591E-02 0.195E-02
DAV: 6 -0.359724819621E+03 -0.26146E-07 -0.24054E-05 53061 0.164E-02
388 F= -.35972482E+03 E0= -.35972879E+03 d E =-.481999E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359692122105E+03 0.32697E-01 -0.23646E+01 57720 0.159E+01 0.106E+00
DAV: 2 -0.359727465569E+03 -0.35343E-01 -0.46029E-01 63726 0.202E+00 0.643E-01
DAV: 3 -0.359724568735E+03 0.28968E-02 -0.10589E-02 68397 0.395E-01 0.350E-01
DAV: 4 -0.359724371386E+03 0.19735E-03 -0.49071E-03 65796 0.254E-01 0.876E-02
DAV: 5 -0.359724398377E+03 -0.26991E-04 -0.90129E-04 69666 0.117E-01 0.395E-02
DAV: 6 -0.359724398766E+03 -0.38881E-06 -0.10134E-04 64491 0.331E-02 0.221E-02
DAV: 7 -0.359724396716E+03 0.20497E-05 -0.18270E-05 47337 0.180E-02
389 F= -.35972440E+03 E0= -.35972837E+03 d E =-.439708E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359714323907E+03 0.10075E-01 -0.81581E+00 57720 0.932E+00 0.611E-01
DAV: 2 -0.359726358866E+03 -0.12035E-01 -0.15686E-01 63519 0.118E+00 0.377E-01
DAV: 3 -0.359725349041E+03 0.10098E-02 -0.36153E-03 67857 0.233E-01 0.200E-01
DAV: 4 -0.359725329856E+03 0.19184E-04 -0.16897E-03 65001 0.148E-01 0.494E-02
DAV: 5 -0.359725334094E+03 -0.42376E-05 -0.31552E-04 69693 0.705E-02 0.228E-02
DAV: 6 -0.359725334089E+03 0.47894E-08 -0.33675E-05 58425 0.192E-02
390 F= -.35972533E+03 E0= -.35972931E+03 d E =-.533446E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359720647352E+03 0.46867E-02 -0.54988E+00 57720 0.766E+00 0.500E-01
DAV: 2 -0.359728744652E+03 -0.80973E-02 -0.10532E-01 62868 0.964E-01 0.309E-01
DAV: 3 -0.359728051367E+03 0.69329E-03 -0.23924E-03 67749 0.192E-01 0.164E-01
DAV: 4 -0.359728029187E+03 0.22180E-04 -0.11420E-03 65202 0.121E-01 0.407E-02
DAV: 5 -0.359728032310E+03 -0.31226E-05 -0.20828E-04 69459 0.573E-02 0.190E-02
DAV: 6 -0.359728032491E+03 -0.18118E-06 -0.22265E-05 51405 0.161E-02
391 F= -.35972803E+03 E0= -.35973201E+03 d E =-.269840E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359708673309E+03 0.19359E-01 -0.15710E+01 57720 0.129E+01 0.853E-01
DAV: 2 -0.359732224783E+03 -0.23551E-01 -0.30483E-01 63141 0.164E+00 0.525E-01
DAV: 3 -0.359730259924E+03 0.19649E-02 -0.68860E-03 68019 0.324E-01 0.283E-01
DAV: 4 -0.359730143487E+03 0.11644E-03 -0.32926E-03 65301 0.207E-01 0.699E-02
DAV: 5 -0.359730156649E+03 -0.13162E-04 -0.60394E-04 69621 0.971E-02 0.325E-02
DAV: 6 -0.359730157155E+03 -0.50602E-06 -0.67586E-05 64617 0.274E-02
392 F= -.35973016E+03 E0= -.35973413E+03 d E =-.482307E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359722807108E+03 0.73495E-02 -0.82267E+00 57720 0.939E+00 0.613E-01
DAV: 2 -0.359735124689E+03 -0.12318E-01 -0.15869E-01 63375 0.118E+00 0.382E-01
DAV: 3 -0.359734071733E+03 0.10530E-02 -0.34325E-03 68217 0.236E-01 0.204E-01
DAV: 4 -0.359734030222E+03 0.41511E-04 -0.17826E-03 65751 0.152E-01 0.497E-02
DAV: 5 -0.359734032287E+03 -0.20653E-05 -0.31774E-04 68946 0.704E-02 0.240E-02
DAV: 6 -0.359734032829E+03 -0.54220E-06 -0.37100E-05 61089 0.202E-02
393 F= -.35973403E+03 E0= -.35973800E+03 d E =-.387567E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359728953282E+03 0.50790E-02 -0.47664E+00 57720 0.714E+00 0.466E-01
DAV: 2 -0.359736031928E+03 -0.70786E-02 -0.91416E-02 63393 0.896E-01 0.290E-01
DAV: 3 -0.359735426548E+03 0.60538E-03 -0.19843E-03 68109 0.180E-01 0.154E-01
DAV: 4 -0.359735412218E+03 0.14330E-04 -0.10312E-03 65805 0.115E-01 0.377E-02
DAV: 5 -0.359735412654E+03 -0.43670E-06 -0.18362E-04 68874 0.537E-02 0.183E-02
DAV: 6 -0.359735412896E+03 -0.24123E-06 -0.20909E-05 50892 0.154E-02
394 F= -.35973541E+03 E0= -.35973938E+03 d E =-.525574E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359734160047E+03 0.12526E-02 -0.10585E+00 57720 0.337E+00 0.219E-01
DAV: 2 -0.359735715306E+03 -0.15553E-02 -0.20219E-02 63582 0.422E-01 0.137E-01
DAV: 3 -0.359735587869E+03 0.12744E-03 -0.43955E-04 68109 0.849E-02 0.722E-02
DAV: 4 -0.359735588952E+03 -0.10834E-05 -0.22912E-04 66372 0.543E-02 0.176E-02
DAV: 5 -0.359735588770E+03 0.18257E-06 -0.40375E-05 62196 0.255E-02
395 F= -.35973559E+03 E0= -.35973956E+03 d E =-.543161E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359723067101E+03 0.12522E-01 -0.12009E+01 57720 0.113E+01 0.742E-01
DAV: 2 -0.359740810566E+03 -0.17743E-01 -0.22876E-01 63267 0.142E+00 0.458E-01
DAV: 3 -0.359739306143E+03 0.15044E-02 -0.49961E-03 68109 0.282E-01 0.246E-01
DAV: 4 -0.359739253049E+03 0.53094E-04 -0.25687E-03 65508 0.182E-01 0.604E-02
DAV: 5 -0.359739254147E+03 -0.10979E-05 -0.45074E-04 69036 0.845E-02 0.287E-02
DAV: 6 -0.359739255418E+03 -0.12709E-05 -0.57253E-05 64437 0.250E-02
396 F= -.35973926E+03 E0= -.35974323E+03 d E =-.366665E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359734321028E+03 0.49331E-02 -0.43787E+00 57720 0.684E+00 0.446E-01
DAV: 2 -0.359740742086E+03 -0.64211E-02 -0.83123E-02 63267 0.855E-01 0.277E-01
DAV: 3 -0.359740198035E+03 0.54405E-03 -0.18178E-03 67938 0.171E-01 0.147E-01
DAV: 4 -0.359740194636E+03 0.33994E-05 -0.93622E-04 65688 0.110E-01 0.359E-02
DAV: 5 -0.359740193810E+03 0.82559E-06 -0.16335E-04 68982 0.510E-02 0.173E-02
DAV: 6 -0.359740194105E+03 -0.29495E-06 -0.19630E-05 48624 0.150E-02
397 F= -.35974019E+03 E0= -.35974417E+03 d E =-.460534E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359737880561E+03 0.23132E-02 -0.39276E+00 57720 0.648E+00 0.424E-01
DAV: 2 -0.359743658504E+03 -0.57779E-02 -0.75561E-02 64230 0.820E-01 0.266E-01
DAV: 3 -0.359743141060E+03 0.51744E-03 -0.17843E-03 68289 0.165E-01 0.142E-01
DAV: 4 -0.359743122618E+03 0.18442E-04 -0.86589E-04 66129 0.106E-01 0.352E-02
DAV: 5 -0.359743124066E+03 -0.14481E-05 -0.15710E-04 69531 0.504E-02 0.166E-02
DAV: 6 -0.359743124197E+03 -0.13125E-06 -0.18308E-05 46176 0.146E-02
398 F= -.35974312E+03 E0= -.35974710E+03 d E =-.293009E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359742630687E+03 0.49338E-03 -0.59932E-01 57720 0.253E+00 0.166E-01
DAV: 2 -0.359743511449E+03 -0.88076E-03 -0.11585E-02 64338 0.321E-01 0.104E-01
DAV: 3 -0.359743438717E+03 0.72731E-04 -0.27187E-04 68280 0.642E-02 0.555E-02
DAV: 4 -0.359743438013E+03 0.70437E-06 -0.13262E-04 66606 0.417E-02 0.137E-02
DAV: 5 -0.359743437957E+03 0.55810E-07 -0.22986E-05 50775 0.199E-02
399 F= -.35974344E+03 E0= -.35974741E+03 d E =-.324385E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359740884122E+03 0.25539E-02 -0.36628E+00 57720 0.625E+00 0.409E-01
DAV: 2 -0.359746269691E+03 -0.53856E-02 -0.70402E-02 63627 0.790E-01 0.257E-01
DAV: 3 -0.359745814675E+03 0.45502E-03 -0.17147E-03 68505 0.159E-01 0.137E-01
DAV: 4 -0.359745799741E+03 0.14934E-04 -0.72947E-04 65823 0.986E-02 0.346E-02
DAV: 5 -0.359745804613E+03 -0.48711E-05 -0.13160E-04 69000 0.443E-02 0.156E-02
DAV: 6 -0.359745804155E+03 0.45728E-06 -0.13621E-05 43611 0.127E-02
400 F= -.35974580E+03 E0= -.35974978E+03 d E =-.236620E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359745327175E+03 0.47744E-03 -0.54552E-01 57720 0.241E+00 0.158E-01
DAV: 2 -0.359746118660E+03 -0.79148E-03 -0.10462E-02 64104 0.305E-01 0.989E-02
DAV: 3 -0.359746055974E+03 0.62687E-04 -0.25724E-04 68478 0.616E-02 0.527E-02
DAV: 4 -0.359746055141E+03 0.83211E-06 -0.10938E-04 66678 0.383E-02 0.133E-02
DAV: 5 -0.359746055669E+03 -0.52713E-06 -0.18750E-05 49263 0.173E-02
401 F= -.35974606E+03 E0= -.35975003E+03 d E =-.261771E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359744010716E+03 0.20444E-02 -0.36704E+00 57720 0.626E+00 0.403E-01
DAV: 2 -0.359749330671E+03 -0.53200E-02 -0.69087E-02 63951 0.781E-01 0.254E-01
DAV: 3 -0.359748883974E+03 0.44670E-03 -0.15798E-03 69027 0.154E-01 0.133E-01
DAV: 4 -0.359748880921E+03 0.30538E-05 -0.70563E-04 66273 0.961E-02 0.321E-02
DAV: 5 -0.359748883123E+03 -0.22019E-05 -0.12136E-04 67929 0.434E-02 0.150E-02
DAV: 6 -0.359748882935E+03 0.18755E-06 -0.13032E-05 43134 0.125E-02
402 F= -.35974888E+03 E0= -.35975285E+03 d E =-.282727E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359746510620E+03 0.23725E-02 -0.25268E+00 57720 0.520E+00 0.334E-01
DAV: 2 -0.359750161010E+03 -0.36504E-02 -0.47615E-02 64059 0.648E-01 0.210E-01
DAV: 3 -0.359749855890E+03 0.30512E-03 -0.10904E-03 68991 0.128E-01 0.110E-01
DAV: 4 -0.359749854739E+03 0.11509E-05 -0.48971E-04 66453 0.802E-02 0.266E-02
DAV: 5 -0.359749856165E+03 -0.14266E-05 -0.84573E-05 68289 0.363E-02
403 F= -.35974986E+03 E0= -.35975383E+03 d E =-.380050E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359748464150E+03 0.13906E-02 -0.32031E+00 57720 0.586E+00 0.375E-01
DAV: 2 -0.359753261966E+03 -0.47978E-02 -0.61048E-02 62943 0.729E-01 0.239E-01
DAV: 3 -0.359752868990E+03 0.39298E-03 -0.13168E-03 68991 0.147E-01 0.126E-01
DAV: 4 -0.359752870090E+03 -0.10991E-05 -0.66502E-04 66120 0.933E-02 0.306E-02
DAV: 5 -0.359752870814E+03 -0.72416E-06 -0.11398E-04 68118 0.426E-02 0.150E-02
DAV: 6 -0.359752871144E+03 -0.33028E-06 -0.14047E-05 42720 0.128E-02
404 F= -.35975287E+03 E0= -.35975684E+03 d E =-.301498E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359747049547E+03 0.58213E-02 -0.53202E+00 57720 0.756E+00 0.482E-01
DAV: 2 -0.359755036941E+03 -0.79874E-02 -0.10190E-01 62862 0.942E-01 0.309E-01
DAV: 3 -0.359754349571E+03 0.68737E-03 -0.22054E-03 69207 0.190E-01 0.164E-01
DAV: 4 -0.359754334060E+03 0.15511E-04 -0.11387E-03 66147 0.122E-01 0.400E-02
DAV: 5 -0.359754335888E+03 -0.18279E-05 -0.19576E-04 68019 0.560E-02 0.196E-02
DAV: 6 -0.359754336643E+03 -0.75494E-06 -0.25217E-05 50343 0.168E-02
405 F= -.35975434E+03 E0= -.35975831E+03 d E =-.448048E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359754002527E+03 0.33336E-03 -0.17418E+00 57720 0.432E+00 0.276E-01
DAV: 2 -0.359756585816E+03 -0.25833E-02 -0.33146E-02 62592 0.537E-01 0.175E-01
DAV: 3 -0.359756381465E+03 0.20435E-03 -0.69757E-04 69036 0.105E-01 0.922E-02
DAV: 4 -0.359756384149E+03 -0.26838E-05 -0.35398E-04 66174 0.691E-02 0.217E-02
DAV: 5 -0.359756384637E+03 -0.48795E-06 -0.61690E-05 67110 0.309E-02
406 F= -.35975638E+03 E0= -.35976036E+03 d E =-.204799E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359737466583E+03 0.18918E-01 -0.15652E+01 57720 0.129E+01 0.834E-01
DAV: 2 -0.359761188398E+03 -0.23722E-01 -0.30090E-01 62655 0.162E+00 0.526E-01
DAV: 3 -0.359759229899E+03 0.19585E-02 -0.62962E-03 69540 0.315E-01 0.284E-01
DAV: 4 -0.359759131599E+03 0.98300E-04 -0.32360E-03 65904 0.209E-01 0.672E-02
DAV: 5 -0.359759140508E+03 -0.89087E-05 -0.57083E-04 67335 0.937E-02 0.325E-02
DAV: 6 -0.359759141980E+03 -0.14726E-05 -0.75669E-05 65247 0.282E-02
407 F= -.35975914E+03 E0= -.35976312E+03 d E =-.480534E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359758337106E+03 0.80340E-03 -0.26238E+00 57720 0.529E+00 0.342E-01
DAV: 2 -0.359762284007E+03 -0.39469E-02 -0.50578E-02 63321 0.664E-01 0.215E-01
DAV: 3 -0.359761982173E+03 0.30183E-03 -0.11080E-03 68928 0.128E-01 0.115E-01
DAV: 4 -0.359761981360E+03 0.81249E-06 -0.51309E-04 65850 0.842E-02 0.275E-02
DAV: 5 -0.359761983826E+03 -0.24660E-05 -0.91816E-05 67794 0.370E-02
408 F= -.35976198E+03 E0= -.35976596E+03 d E =-.284185E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359757798211E+03 0.41831E-02 -0.45621E+00 57720 0.698E+00 0.451E-01
DAV: 2 -0.359764699324E+03 -0.69011E-02 -0.87869E-02 63285 0.875E-01 0.283E-01
DAV: 3 -0.359764171922E+03 0.52740E-03 -0.19004E-03 69117 0.168E-01 0.152E-01
DAV: 4 -0.359764165236E+03 0.66859E-05 -0.89389E-04 65697 0.111E-01 0.364E-02
DAV: 5 -0.359764169144E+03 -0.39086E-05 -0.16001E-04 67686 0.490E-02 0.170E-02
DAV: 6 -0.359764168870E+03 0.27377E-06 -0.17815E-05 44286 0.143E-02
409 F= -.35976417E+03 E0= -.35976814E+03 d E =-.502689E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359737547538E+03 0.26622E-01 -0.18234E+01 57720 0.139E+01 0.907E-01
DAV: 2 -0.359765570444E+03 -0.28023E-01 -0.35641E-01 63420 0.176E+00 0.567E-01
DAV: 3 -0.359763342997E+03 0.22274E-02 -0.77402E-03 69639 0.338E-01 0.312E-01
DAV: 4 -0.359763187865E+03 0.15513E-03 -0.37170E-03 66111 0.227E-01 0.757E-02
DAV: 5 -0.359763208908E+03 -0.21043E-04 -0.67749E-04 67668 0.101E-01 0.347E-02
DAV: 6 -0.359763208781E+03 0.12676E-06 -0.82485E-05 65976 0.297E-02
410 F= -.35976321E+03 E0= -.35976718E+03 d E =-.406680E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359753889380E+03 0.93195E-02 -0.78735E+00 57720 0.916E+00 0.587E-01
DAV: 2 -0.359765568801E+03 -0.11679E-01 -0.14992E-01 63075 0.114E+00 0.370E-01
DAV: 3 -0.359764654435E+03 0.91437E-03 -0.32889E-03 69009 0.221E-01 0.198E-01
DAV: 4 -0.359764623397E+03 0.31038E-04 -0.15072E-03 65247 0.143E-01 0.469E-02
DAV: 5 -0.359764631661E+03 -0.82640E-05 -0.27374E-04 68460 0.640E-02 0.221E-02
DAV: 6 -0.359764631465E+03 0.19608E-06 -0.30011E-05 56211 0.183E-02
411 F= -.35976463E+03 E0= -.35976860E+03 d E =-.548948E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359762457773E+03 0.21739E-02 -0.37172E+00 57720 0.629E+00 0.404E-01
DAV: 2 -0.359768112589E+03 -0.56548E-02 -0.72451E-02 62976 0.792E-01 0.258E-01
DAV: 3 -0.359767654523E+03 0.45807E-03 -0.15453E-03 68784 0.156E-01 0.141E-01
DAV: 4 -0.359767638209E+03 0.16314E-04 -0.82045E-04 64986 0.105E-01 0.342E-02
DAV: 5 -0.359767641317E+03 -0.31078E-05 -0.14453E-04 68190 0.484E-02 0.164E-02
DAV: 6 -0.359767641725E+03 -0.40832E-06 -0.18346E-05 42882 0.145E-02
412 F= -.35976764E+03 E0= -.35977161E+03 d E =-.301026E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359761918000E+03 0.57233E-02 -0.49692E+00 57720 0.728E+00 0.470E-01
DAV: 2 -0.359769589985E+03 -0.76720E-02 -0.97742E-02 63312 0.919E-01 0.299E-01
DAV: 3 -0.359768974237E+03 0.61575E-03 -0.20707E-03 68910 0.180E-01 0.164E-01
DAV: 4 -0.359768947679E+03 0.26558E-04 -0.11147E-03 65346 0.123E-01 0.398E-02
DAV: 5 -0.359768951298E+03 -0.36183E-05 -0.19618E-04 68226 0.567E-02 0.191E-02
DAV: 6 -0.359768951949E+03 -0.65120E-06 -0.27078E-05 53178 0.170E-02
413 F= -.35976895E+03 E0= -.35977292E+03 d E =-.432048E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359767192520E+03 0.17588E-02 -0.33047E+00 57723 0.594E+00 0.382E-01
DAV: 2 -0.359772293434E+03 -0.51009E-02 -0.64808E-02 63753 0.746E-01 0.241E-01
DAV: 3 -0.359771899389E+03 0.39405E-03 -0.13041E-03 68943 0.144E-01 0.130E-01
DAV: 4 -0.359771896607E+03 0.27817E-05 -0.71194E-04 66066 0.101E-01 0.311E-02
DAV: 5 -0.359771898191E+03 -0.15833E-05 -0.12719E-04 67686 0.448E-02 0.155E-02
DAV: 6 -0.359771898431E+03 -0.24069E-06 -0.17780E-05 42873 0.141E-02
414 F= -.35977190E+03 E0= -.35977587E+03 d E =-.294648E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359768870775E+03 0.30274E-02 -0.30632E+00 57720 0.572E+00 0.367E-01
DAV: 2 -0.359773585765E+03 -0.47150E-02 -0.59968E-02 63744 0.718E-01 0.232E-01
DAV: 3 -0.359773220534E+03 0.36523E-03 -0.12061E-03 69000 0.139E-01 0.125E-01
DAV: 4 -0.359773218432E+03 0.21019E-05 -0.65932E-04 66246 0.968E-02 0.299E-02
DAV: 5 -0.359773219895E+03 -0.14626E-05 -0.11770E-04 67452 0.430E-02 0.150E-02
DAV: 6 -0.359773220102E+03 -0.20747E-06 -0.16312E-05 42837 0.135E-02
415 F= -.35977322E+03 E0= -.35977719E+03 d E =-.426815E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359772768599E+03 0.45130E-03 -0.39220E-01 57738 0.205E+00 0.132E-01
DAV: 2 -0.359773365550E+03 -0.59695E-03 -0.76632E-03 63834 0.257E-01 0.830E-02
DAV: 3 -0.359773323650E+03 0.41900E-04 -0.15386E-04 69045 0.497E-02 0.444E-02
DAV: 4 -0.359773325390E+03 -0.17404E-05 -0.83220E-05 66867 0.344E-02
416 F= -.35977333E+03 E0= -.35977730E+03 d E =-.437344E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359769988729E+03 0.33349E-02 -0.44438E+00 57720 0.690E+00 0.441E-01
DAV: 2 -0.359776996816E+03 -0.70081E-02 -0.87817E-02 62298 0.864E-01 0.279E-01
DAV: 3 -0.359776465933E+03 0.53088E-03 -0.17122E-03 69396 0.167E-01 0.151E-01
DAV: 4 -0.359776458068E+03 0.78657E-05 -0.94312E-04 65463 0.116E-01 0.357E-02
DAV: 5 -0.359776460677E+03 -0.26090E-05 -0.16972E-04 66894 0.513E-02 0.180E-02
DAV: 6 -0.359776461025E+03 -0.34812E-06 -0.24130E-05 48309 0.161E-02
417 F= -.35977646E+03 E0= -.35978044E+03 d E =-.313563E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359775568520E+03 0.89216E-03 -0.12905E+00 57720 0.372E+00 0.237E-01
DAV: 2 -0.359777572747E+03 -0.20042E-02 -0.25398E-02 62574 0.465E-01 0.150E-01
DAV: 3 -0.359777430901E+03 0.14185E-03 -0.49698E-04 69261 0.895E-02 0.805E-02
DAV: 4 -0.359777433831E+03 -0.29294E-05 -0.26798E-04 66066 0.621E-02 0.188E-02
DAV: 5 -0.359777434577E+03 -0.74596E-06 -0.48048E-05 65148 0.272E-02
418 F= -.35977743E+03 E0= -.35978141E+03 d E =-.410919E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359770360794E+03 0.70730E-02 -0.51555E+00 57720 0.743E+00 0.474E-01
DAV: 2 -0.359778487521E+03 -0.81267E-02 -0.10170E-01 62436 0.930E-01 0.299E-01
DAV: 3 -0.359777869585E+03 0.61794E-03 -0.19743E-03 69450 0.179E-01 0.162E-01
DAV: 4 -0.359777857357E+03 0.12228E-04 -0.10880E-03 65427 0.125E-01 0.383E-02
DAV: 5 -0.359777860072E+03 -0.27149E-05 -0.19677E-04 66903 0.552E-02 0.193E-02
DAV: 6 -0.359777860523E+03 -0.45064E-06 -0.28454E-05 54645 0.173E-02
419 F= -.35977786E+03 E0= -.35978184E+03 d E =-.453513E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359777102913E+03 0.75716E-03 -0.17811E+00 57720 0.436E+00 0.278E-01
DAV: 2 -0.359779887930E+03 -0.27850E-02 -0.35119E-02 62448 0.547E-01 0.177E-01
DAV: 3 -0.359779690960E+03 0.19697E-03 -0.66652E-04 69000 0.105E-01 0.965E-02
DAV: 4 -0.359779694399E+03 -0.34392E-05 -0.39643E-04 65742 0.743E-02 0.230E-02
DAV: 5 -0.359779694599E+03 -0.20031E-06 -0.70858E-05 67317 0.342E-02
420 F= -.35977969E+03 E0= -.35978367E+03 d E =-.183408E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359758701034E+03 0.20993E-01 -0.16005E+01 57720 0.131E+01 0.840E-01
DAV: 2 -0.359784541966E+03 -0.25841E-01 -0.32069E-01 62574 0.165E+00 0.533E-01
DAV: 3 -0.359782577005E+03 0.19650E-02 -0.61117E-03 69540 0.319E-01 0.297E-01
DAV: 4 -0.359782448617E+03 0.12839E-03 -0.37383E-03 64995 0.228E-01 0.719E-02
DAV: 5 -0.359782452843E+03 -0.42263E-05 -0.66627E-04 67704 0.106E-01 0.351E-02
DAV: 6 -0.359782456679E+03 -0.38356E-05 -0.10308E-04 64455 0.323E-02 0.190E-02
DAV: 7 -0.359782454374E+03 0.23044E-05 -0.11543E-05 42891 0.156E-02
421 F= -.35978245E+03 E0= -.35978643E+03 d E =-.459385E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359784069062E+03 -0.16124E-02 -0.66117E-01 57726 0.266E+00 0.173E-01
DAV: 2 -0.359785119264E+03 -0.10502E-02 -0.13618E-02 64041 0.345E-01 0.109E-01
DAV: 3 -0.359785042399E+03 0.76865E-04 -0.31252E-04 69954 0.678E-02 0.606E-02
DAV: 4 -0.359785040687E+03 0.17116E-05 -0.15036E-04 66282 0.459E-02 0.161E-02
DAV: 5 -0.359785041563E+03 -0.87586E-06 -0.24837E-05 55113 0.210E-02
422 F= -.35978504E+03 E0= -.35978902E+03 d E =-.258719E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359783002960E+03 0.20377E-02 -0.29271E+00 57720 0.560E+00 0.365E-01
DAV: 2 -0.359787728730E+03 -0.47258E-02 -0.60373E-02 64041 0.726E-01 0.230E-01
DAV: 3 -0.359787369421E+03 0.35931E-03 -0.13682E-03 70026 0.142E-01 0.128E-01
DAV: 4 -0.359787355614E+03 0.13808E-04 -0.66037E-04 65373 0.957E-02 0.336E-02
DAV: 5 -0.359787359837E+03 -0.42232E-05 -0.11361E-04 69594 0.440E-02 0.147E-02
DAV: 6 -0.359787360017E+03 -0.17960E-06 -0.15545E-05 42513 0.132E-02
423 F= -.35978736E+03 E0= -.35979133E+03 d E =-.490564E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359788224153E+03 -0.86432E-03 -0.46732E-01 57720 0.223E+00 0.145E-01
DAV: 2 -0.359789034347E+03 -0.81019E-03 -0.10102E-02 64545 0.290E-01 0.921E-02
DAV: 3 -0.359788979282E+03 0.55065E-04 -0.22458E-04 69945 0.556E-02 0.518E-02
DAV: 4 -0.359788975099E+03 0.41827E-05 -0.95805E-05 66165 0.388E-02
424 F= -.35978898E+03 E0= -.35979295E+03 d E =-.161508E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359789259206E+03 -0.27992E-03 -0.15765E-01 57795 0.129E+00 0.865E-02
DAV: 2 -0.359789530939E+03 -0.27173E-03 -0.33676E-03 64995 0.168E-01 0.537E-02
DAV: 3 -0.359789514141E+03 0.16798E-04 -0.73090E-05 70392 0.325E-02 0.304E-02
DAV: 4 -0.359789513784E+03 0.35714E-06 -0.32747E-05 56904 0.226E-02
425 F= -.35978951E+03 E0= -.35979349E+03 d E =-.215377E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359788706367E+03 0.80777E-03 -0.62842E-01 57720 0.258E+00 0.169E-01
DAV: 2 -0.359789785886E+03 -0.10795E-02 -0.13442E-02 64698 0.335E-01 0.107E-01
DAV: 3 -0.359789712583E+03 0.73303E-04 -0.29419E-04 69945 0.642E-02 0.600E-02
DAV: 4 -0.359789707773E+03 0.48103E-05 -0.13041E-04 66084 0.449E-02 0.153E-02
DAV: 5 -0.359789709515E+03 -0.17419E-05 -0.26224E-05 59010 0.190E-02
426 F= -.35978971E+03 E0= -.35979368E+03 d E =-.234950E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359790302603E+03 -0.59483E-03 -0.26447E-01 57720 0.167E+00 0.106E-01
DAV: 2 -0.359790729036E+03 -0.42643E-03 -0.53014E-03 64149 0.210E-01 0.674E-02
DAV: 3 -0.359790703647E+03 0.25389E-04 -0.99180E-05 70071 0.396E-02 0.375E-02
DAV: 4 -0.359790704680E+03 -0.10334E-05 -0.55743E-05 65571 0.280E-02
427 F= -.35979070E+03 E0= -.35979468E+03 d E =-.995165E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359789197387E+03 0.15063E-02 -0.23822E+00 57720 0.502E+00 0.317E-01
DAV: 2 -0.359793038914E+03 -0.38415E-02 -0.47762E-02 64041 0.631E-01 0.203E-01
DAV: 3 -0.359792773703E+03 0.26521E-03 -0.91184E-04 69810 0.120E-01 0.114E-01
DAV: 4 -0.359792769190E+03 0.45128E-05 -0.52908E-04 65445 0.862E-02 0.275E-02
DAV: 5 -0.359792770258E+03 -0.10686E-05 -0.97856E-05 67371 0.406E-02
428 F= -.35979277E+03 E0= -.35979675E+03 d E =-.306074E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359778301677E+03 0.14468E-01 -0.95129E+00 57720 0.100E+01 0.634E-01
DAV: 2 -0.359793946463E+03 -0.15645E-01 -0.19253E-01 64131 0.127E+00 0.406E-01
DAV: 3 -0.359792813247E+03 0.11332E-02 -0.36815E-03 70404 0.240E-01 0.229E-01
DAV: 4 -0.359792739282E+03 0.73964E-04 -0.21372E-03 64995 0.173E-01 0.553E-02
DAV: 5 -0.359792743911E+03 -0.46290E-05 -0.39232E-04 67731 0.814E-02 0.258E-02
DAV: 6 -0.359792745894E+03 -0.19822E-05 -0.57116E-05 64572 0.239E-02
429 F= -.35979275E+03 E0= -.35979672E+03 d E =-.303638E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359789621969E+03 0.31219E-02 -0.25888E+00 57720 0.524E+00 0.326E-01
DAV: 2 -0.359793748854E+03 -0.41269E-02 -0.51704E-02 63816 0.656E-01 0.211E-01
DAV: 3 -0.359793451759E+03 0.29709E-03 -0.99328E-04 69810 0.124E-01 0.118E-01
DAV: 4 -0.359793448786E+03 0.29738E-05 -0.56065E-04 64224 0.889E-02 0.280E-02
DAV: 5 -0.359793451054E+03 -0.22685E-05 -0.10477E-04 66993 0.416E-02 0.133E-02
DAV: 6 -0.359793451524E+03 -0.47010E-06 -0.13475E-05 41694 0.122E-02
430 F= -.35979345E+03 E0= -.35979743E+03 d E =-.374201E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359795258204E+03 -0.18071E-02 -0.11183E+00 57720 0.347E+00 0.213E-01
DAV: 2 -0.359797104405E+03 -0.18462E-02 -0.22940E-02 63771 0.436E-01 0.142E-01
DAV: 3 -0.359796961570E+03 0.14284E-03 -0.45292E-04 69756 0.880E-02 0.787E-02
DAV: 4 -0.359796953298E+03 0.82719E-05 -0.26033E-04 67209 0.592E-02 0.189E-02
DAV: 5 -0.359796955526E+03 -0.22285E-05 -0.45256E-05 63114 0.262E-02
431 F= -.35979696E+03 E0= -.35980093E+03 d E =-.350400E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359796024134E+03 0.92916E-03 -0.15719E+00 57720 0.411E+00 0.256E-01
DAV: 2 -0.359798674055E+03 -0.26499E-02 -0.32620E-02 63870 0.519E-01 0.169E-01
DAV: 3 -0.359798477232E+03 0.19682E-03 -0.63131E-04 69846 0.104E-01 0.939E-02
DAV: 4 -0.359798467154E+03 0.10078E-04 -0.37087E-04 67083 0.708E-02 0.225E-02
DAV: 5 -0.359798469918E+03 -0.27644E-05 -0.64777E-05 66489 0.315E-02
432 F= -.35979847E+03 E0= -.35980244E+03 d E =-.501839E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359799474370E+03 -0.10072E-02 -0.10237E+00 57720 0.332E+00 0.207E-01
DAV: 2 -0.359801262162E+03 -0.17878E-02 -0.21952E-02 64545 0.424E-01 0.134E-01
DAV: 3 -0.359801146754E+03 0.11541E-03 -0.45638E-04 70467 0.809E-02 0.730E-02
DAV: 4 -0.359801139753E+03 0.70013E-05 -0.18165E-04 67029 0.529E-02 0.170E-02
DAV: 5 -0.359801143648E+03 -0.38955E-05 -0.36893E-05 66246 0.212E-02
433 F= -.35980114E+03 E0= -.35980512E+03 d E =-.267373E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359800825194E+03 0.31456E-03 -0.58293E-01 57726 0.251E+00 0.156E-01
DAV: 2 -0.359801833364E+03 -0.10082E-02 -0.12409E-02 64608 0.319E-01 0.100E-01
DAV: 3 -0.359801768959E+03 0.64404E-04 -0.25651E-04 70611 0.609E-02 0.546E-02
DAV: 4 -0.359801765670E+03 0.32898E-05 -0.10317E-04 66984 0.397E-02 0.127E-02
DAV: 5 -0.359801767655E+03 -0.19854E-05 -0.19572E-05 49659 0.160E-02
434 F= -.35980177E+03 E0= -.35980574E+03 d E =-.329774E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359802824797E+03 -0.10591E-02 -0.61884E-01 57720 0.258E+00 0.161E-01
DAV: 2 -0.359803859381E+03 -0.10346E-02 -0.12928E-02 65256 0.330E-01 0.104E-01
DAV: 3 -0.359803796841E+03 0.62540E-04 -0.24855E-04 70512 0.604E-02 0.587E-02
DAV: 4 -0.359803796863E+03 -0.21855E-07 -0.13410E-04 66804 0.443E-02 0.138E-02
DAV: 5 -0.359803797821E+03 -0.95748E-06 -0.23454E-05 54249 0.199E-02
435 F= -.35980380E+03 E0= -.35980777E+03 d E =-.203017E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359803509222E+03 0.28764E-03 -0.63298E-01 57720 0.261E+00 0.163E-01
DAV: 2 -0.359804569878E+03 -0.10607E-02 -0.13236E-02 65274 0.334E-01 0.105E-01
DAV: 3 -0.359804506726E+03 0.63152E-04 -0.25418E-04 70593 0.610E-02 0.595E-02
DAV: 4 -0.359804507333E+03 -0.60687E-06 -0.13690E-04 66768 0.446E-02 0.139E-02
DAV: 5 -0.359804508294E+03 -0.96094E-06 -0.23874E-05 54519 0.202E-02
436 F= -.35980451E+03 E0= -.35980848E+03 d E =-.274064E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359805575156E+03 -0.10678E-02 -0.66438E-01 57720 0.267E+00 0.167E-01
DAV: 2 -0.359806695426E+03 -0.11203E-02 -0.14055E-02 64572 0.344E-01 0.109E-01
DAV: 3 -0.359806624002E+03 0.71424E-04 -0.28596E-04 70611 0.650E-02 0.622E-02
DAV: 4 -0.359806621833E+03 0.21691E-05 -0.15244E-04 66768 0.471E-02 0.155E-02
DAV: 5 -0.359806623484E+03 -0.16511E-05 -0.25656E-05 54933 0.207E-02
437 F= -.35980662E+03 E0= -.35981060E+03 d E =-.211519E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359805190670E+03 0.14312E-02 -0.17462E+00 57720 0.432E+00 0.270E-01
DAV: 2 -0.359808167614E+03 -0.29769E-02 -0.37210E-02 64527 0.559E-01 0.176E-01
DAV: 3 -0.359807970551E+03 0.19706E-03 -0.75833E-04 70377 0.106E-01 0.102E-01
DAV: 4 -0.359807958496E+03 0.12055E-04 -0.41447E-04 66471 0.775E-02 0.256E-02
DAV: 5 -0.359807963050E+03 -0.45539E-05 -0.72970E-05 67947 0.344E-02
438 F= -.35980796E+03 E0= -.35981194E+03 d E =-.345476E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359808757564E+03 -0.79907E-03 -0.74599E-01 57720 0.281E+00 0.175E-01
DAV: 2 -0.359810060576E+03 -0.13030E-02 -0.15965E-02 64266 0.358E-01 0.113E-01
DAV: 3 -0.359809981645E+03 0.78930E-04 -0.28114E-04 70350 0.633E-02 0.629E-02
DAV: 4 -0.359809978084E+03 0.35612E-05 -0.14042E-04 66849 0.471E-02 0.134E-02
DAV: 5 -0.359809981060E+03 -0.29753E-05 -0.29386E-05 62655 0.185E-02
439 F= -.35980998E+03 E0= -.35981396E+03 d E =-.201801E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359809102546E+03 0.87554E-03 -0.11112E+00 57720 0.343E+00 0.212E-01
DAV: 2 -0.359811023504E+03 -0.19210E-02 -0.23629E-02 64329 0.436E-01 0.137E-01
DAV: 3 -0.359810899842E+03 0.12366E-03 -0.41710E-04 70395 0.773E-02 0.764E-02
DAV: 4 -0.359810891343E+03 0.84991E-05 -0.21120E-04 66858 0.577E-02 0.164E-02
DAV: 5 -0.359810895734E+03 -0.43910E-05 -0.44273E-05 66282 0.226E-02
440 F= -.35981090E+03 E0= -.35981487E+03 d E =-.293268E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359811798849E+03 -0.90751E-03 -0.73832E-01 57720 0.281E+00 0.169E-01
DAV: 2 -0.359813058412E+03 -0.12596E-02 -0.15304E-02 64014 0.355E-01 0.111E-01
DAV: 3 -0.359812981968E+03 0.76444E-04 -0.27204E-04 71169 0.660E-02 0.615E-02
DAV: 4 -0.359812982470E+03 -0.50193E-06 -0.14418E-04 67497 0.454E-02 0.138E-02
DAV: 5 -0.359812984217E+03 -0.17477E-05 -0.24429E-05 54591 0.187E-02
441 F= -.35981298E+03 E0= -.35981696E+03 d E =-.208848E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359811490866E+03 0.14916E-02 -0.17284E+00 57720 0.429E+00 0.259E-01
DAV: 2 -0.359814438904E+03 -0.29480E-02 -0.35839E-02 64050 0.543E-01 0.170E-01
DAV: 3 -0.359814251557E+03 0.18735E-03 -0.64046E-04 71133 0.101E-01 0.944E-02
DAV: 4 -0.359814249239E+03 0.23178E-05 -0.34478E-04 67641 0.702E-02 0.214E-02
DAV: 5 -0.359814253469E+03 -0.42300E-05 -0.60316E-05 65814 0.291E-02
442 F= -.35981425E+03 E0= -.35981823E+03 d E =-.335773E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359815087879E+03 -0.83864E-03 -0.85587E-01 57720 0.301E+00 0.183E-01
DAV: 2 -0.359816568742E+03 -0.14809E-02 -0.17852E-02 63168 0.380E-01 0.121E-01
DAV: 3 -0.359816477844E+03 0.90898E-04 -0.28696E-04 71052 0.698E-02 0.694E-02
DAV: 4 -0.359816477194E+03 0.64935E-06 -0.20333E-04 67416 0.545E-02 0.156E-02
DAV: 5 -0.359816478531E+03 -0.13366E-05 -0.37058E-05 61125 0.239E-02
443 F= -.35981648E+03 E0= -.35982045E+03 d E =-.222506E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359812914256E+03 0.35629E-02 -0.32889E+00 57720 0.591E+00 0.359E-01
DAV: 2 -0.359818658148E+03 -0.57439E-02 -0.69191E-02 62970 0.746E-01 0.239E-01
DAV: 3 -0.359818279984E+03 0.37816E-03 -0.11276E-03 70962 0.138E-01 0.138E-01
DAV: 4 -0.359818263243E+03 0.16741E-04 -0.81973E-04 67182 0.109E-01 0.314E-02
DAV: 5 -0.359818268748E+03 -0.55047E-05 -0.15031E-04 67974 0.482E-02 0.168E-02
DAV: 6 -0.359818269953E+03 -0.12052E-05 -0.22856E-05 49578 0.152E-02
444 F= -.35981827E+03 E0= -.35982224E+03 d E =-.401648E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359818985761E+03 -0.71701E-03 -0.84241E-01 57726 0.298E+00 0.183E-01
DAV: 2 -0.359820468146E+03 -0.14824E-02 -0.18044E-02 64536 0.380E-01 0.119E-01
DAV: 3 -0.359820381450E+03 0.86696E-04 -0.29356E-04 70071 0.649E-02 0.675E-02
DAV: 4 -0.359820381358E+03 0.92734E-07 -0.17108E-04 67470 0.523E-02 0.150E-02
DAV: 5 -0.359820384205E+03 -0.28478E-05 -0.34966E-05 63573 0.217E-02
445 F= -.35982038E+03 E0= -.35982436E+03 d E =-.211425E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359815401213E+03 0.49801E-02 -0.42097E+00 57720 0.665E+00 0.409E-01
DAV: 2 -0.359822832311E+03 -0.74311E-02 -0.90044E-02 64473 0.848E-01 0.266E-01
DAV: 3 -0.359822378673E+03 0.45364E-03 -0.14486E-03 70008 0.145E-01 0.152E-01
DAV: 4 -0.359822369587E+03 0.90864E-05 -0.87736E-04 66993 0.117E-01 0.339E-02
DAV: 5 -0.359822382425E+03 -0.12838E-04 -0.17425E-04 66147 0.490E-02 0.177E-02
DAV: 6 -0.359822382808E+03 -0.38301E-06 -0.25549E-05 53394 0.163E-02
446 F= -.35982238E+03 E0= -.35982636E+03 d E =-.411285E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359822778997E+03 -0.39657E-03 -0.13368E+00 57720 0.374E+00 0.230E-01
DAV: 2 -0.359825050469E+03 -0.22715E-02 -0.28003E-02 64320 0.476E-01 0.151E-01
DAV: 3 -0.359824916287E+03 0.13418E-03 -0.48627E-04 69369 0.842E-02 0.856E-02
DAV: 4 -0.359824921470E+03 -0.51822E-05 -0.28893E-04 67749 0.648E-02 0.201E-02
DAV: 5 -0.359824924329E+03 -0.28590E-05 -0.53318E-05 65913 0.286E-02
447 F= -.35982492E+03 E0= -.35982890E+03 d E =-.254152E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359820373976E+03 0.45475E-02 -0.38755E+00 57720 0.637E+00 0.392E-01
DAV: 2 -0.359827015842E+03 -0.66419E-02 -0.81440E-02 64356 0.811E-01 0.257E-01
DAV: 3 -0.359826615913E+03 0.39993E-03 -0.14044E-03 69432 0.144E-01 0.147E-01
DAV: 4 -0.359826628247E+03 -0.12335E-04 -0.85990E-04 67173 0.111E-01 0.348E-02
DAV: 5 -0.359826636173E+03 -0.79261E-05 -0.15802E-04 68208 0.496E-02 0.165E-02
DAV: 6 -0.359826637086E+03 -0.91247E-06 -0.21082E-05 51369 0.144E-02
448 F= -.35982664E+03 E0= -.35983061E+03 d E =-.425428E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359826038573E+03 0.59760E-03 -0.22157E+00 57720 0.482E+00 0.291E-01
DAV: 2 -0.359829843475E+03 -0.38049E-02 -0.46505E-02 63339 0.608E-01 0.198E-01
DAV: 3 -0.359829591490E+03 0.25198E-03 -0.77447E-04 69792 0.112E-01 0.114E-01
DAV: 4 -0.359829590227E+03 0.12629E-05 -0.55086E-04 67425 0.877E-02 0.264E-02
DAV: 5 -0.359829593898E+03 -0.36707E-05 -0.10041E-04 68172 0.395E-02 0.134E-02
DAV: 6 -0.359829594737E+03 -0.83916E-06 -0.13464E-05 40893 0.117E-02
449 F= -.35982959E+03 E0= -.35983357E+03 d E =-.295765E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359826488200E+03 0.31057E-02 -0.26088E+00 57720 0.524E+00 0.316E-01
DAV: 2 -0.359831020843E+03 -0.45326E-02 -0.55290E-02 63393 0.661E-01 0.216E-01
DAV: 3 -0.359830719303E+03 0.30154E-03 -0.91754E-04 69819 0.123E-01 0.125E-01
DAV: 4 -0.359830716287E+03 0.30157E-05 -0.66358E-04 67344 0.963E-02 0.290E-02
DAV: 5 -0.359830720680E+03 -0.43929E-05 -0.12120E-04 68253 0.435E-02 0.146E-02
DAV: 6 -0.359830721781E+03 -0.11005E-05 -0.16769E-05 45222 0.129E-02
450 F= -.35983072E+03 E0= -.35983469E+03 d E =-.408469E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359829790914E+03 0.92977E-03 -0.23900E+00 57720 0.501E+00 0.300E-01
DAV: 2 -0.359833929669E+03 -0.41388E-02 -0.50364E-02 64455 0.629E-01 0.201E-01
DAV: 3 -0.359833657263E+03 0.27241E-03 -0.77705E-04 70224 0.110E-01 0.113E-01
DAV: 4 -0.359833655990E+03 0.12729E-05 -0.49660E-04 67326 0.863E-02 0.239E-02
DAV: 5 -0.359833663879E+03 -0.78896E-05 -0.96533E-05 65571 0.351E-02
451 F= -.35983366E+03 E0= -.35983763E+03 d E =-.294210E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359832248658E+03 0.14073E-02 -0.15113E+00 57720 0.399E+00 0.239E-01
DAV: 2 -0.359834851448E+03 -0.26028E-02 -0.31562E-02 64617 0.498E-01 0.159E-01
DAV: 3 -0.359834687240E+03 0.16421E-03 -0.47965E-04 70341 0.876E-02 0.894E-02
DAV: 4 -0.359834690357E+03 -0.31171E-05 -0.30766E-04 67263 0.677E-02 0.188E-02
DAV: 5 -0.359834694933E+03 -0.45765E-05 -0.59507E-05 65544 0.276E-02
452 F= -.35983469E+03 E0= -.35983867E+03 d E =-.397315E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359834471460E+03 0.21890E-03 -0.19008E-01 57750 0.141E+00 0.850E-02
DAV: 2 -0.359834798776E+03 -0.32732E-03 -0.39442E-03 65013 0.176E-01 0.559E-02
DAV: 3 -0.359834779527E+03 0.19249E-04 -0.58650E-05 68217 0.309E-02 0.313E-02
DAV: 4 -0.359834780327E+03 -0.80027E-06 -0.37744E-05 64815 0.237E-02
453 F= -.35983478E+03 E0= -.35983875E+03 d E =-.405855E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359833728313E+03 0.10512E-02 -0.26429E+00 57720 0.528E+00 0.314E-01
DAV: 2 -0.359838164947E+03 -0.44366E-02 -0.53925E-02 63357 0.657E-01 0.210E-01
DAV: 3 -0.359837875597E+03 0.28935E-03 -0.82626E-04 70107 0.117E-01 0.119E-01
DAV: 4 -0.359837884656E+03 -0.90595E-05 -0.57566E-04 67308 0.916E-02 0.254E-02
DAV: 5 -0.359837891735E+03 -0.70790E-05 -0.10830E-04 65715 0.392E-02 0.133E-02
DAV: 6 -0.359837892406E+03 -0.67092E-06 -0.12230E-05 41487 0.112E-02
454 F= -.35983789E+03 E0= -.35984186E+03 d E =-.311208E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359837086080E+03 0.80566E-03 -0.12204E+00 57720 0.359E+00 0.213E-01
DAV: 2 -0.359839129860E+03 -0.20438E-02 -0.24886E-02 63438 0.447E-01 0.143E-01
DAV: 3 -0.359838997545E+03 0.13232E-03 -0.38057E-04 70179 0.792E-02 0.802E-02
DAV: 4 -0.359839002080E+03 -0.45354E-05 -0.26189E-04 67578 0.619E-02 0.170E-02
DAV: 5 -0.359839005322E+03 -0.32414E-05 -0.49490E-05 65076 0.264E-02
455 F= -.35983901E+03 E0= -.35984298E+03 d E =-.422499E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359831043181E+03 0.79589E-02 -0.48754E+00 57720 0.717E+00 0.428E-01
DAV: 2 -0.359839312739E+03 -0.82696E-02 -0.10017E-01 63411 0.895E-01 0.286E-01
DAV: 3 -0.359838769307E+03 0.54343E-03 -0.15356E-03 70089 0.160E-01 0.162E-01
DAV: 4 -0.359838778198E+03 -0.88910E-05 -0.10764E-03 67371 0.125E-01 0.350E-02
DAV: 5 -0.359838791538E+03 -0.13339E-04 -0.20281E-04 65904 0.536E-02 0.182E-02
DAV: 6 -0.359838792940E+03 -0.14029E-05 -0.23627E-05 52368 0.152E-02
456 F= -.35983879E+03 E0= -.35984277E+03 d E =-.401261E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359836701602E+03 0.20899E-02 -0.17004E+00 57720 0.423E+00 0.249E-01
DAV: 2 -0.359839505100E+03 -0.28035E-02 -0.34077E-02 62955 0.524E-01 0.168E-01
DAV: 3 -0.359839311161E+03 0.19394E-03 -0.52670E-04 70062 0.921E-02 0.934E-02
DAV: 4 -0.359839306986E+03 0.41742E-05 -0.34830E-04 68181 0.712E-02 0.192E-02
DAV: 5 -0.359839311380E+03 -0.43937E-05 -0.65395E-05 64770 0.301E-02
457 F= -.35983931E+03 E0= -.35984328E+03 d E =-.453105E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359835884077E+03 0.34229E-02 -0.40091E+00 57720 0.650E+00 0.389E-01
DAV: 2 -0.359842825728E+03 -0.69417E-02 -0.85069E-02 62031 0.825E-01 0.268E-01
DAV: 3 -0.359842344571E+03 0.48116E-03 -0.14261E-03 69315 0.151E-01 0.157E-01
DAV: 4 -0.359842319202E+03 0.25369E-04 -0.10528E-03 67398 0.122E-01 0.363E-02
DAV: 5 -0.359842328501E+03 -0.92993E-05 -0.19153E-04 68298 0.545E-02 0.186E-02
DAV: 6 -0.359842330432E+03 -0.19305E-05 -0.29038E-05 59091 0.165E-02
458 F= -.35984233E+03 E0= -.35984630E+03 d E =-.301905E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359841898337E+03 0.43016E-03 -0.38377E-01 57720 0.201E+00 0.122E-01
DAV: 2 -0.359842577471E+03 -0.67913E-03 -0.82621E-03 62727 0.256E-01 0.829E-02
DAV: 3 -0.359842534682E+03 0.42788E-04 -0.13442E-04 69648 0.460E-02 0.482E-02
DAV: 4 -0.359842534316E+03 0.36622E-06 -0.97750E-05 67722 0.373E-02
459 F= -.35984253E+03 E0= -.35984651E+03 d E =-.322294E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359839054121E+03 0.34806E-02 -0.41569E+00 57720 0.658E+00 0.401E-01
DAV: 2 -0.359846230236E+03 -0.71761E-02 -0.88281E-02 63483 0.834E-01 0.265E-01
DAV: 3 -0.359845801365E+03 0.42887E-03 -0.14827E-03 69351 0.145E-01 0.151E-01
DAV: 4 -0.359845809105E+03 -0.77404E-05 -0.84734E-04 67920 0.115E-01 0.344E-02
DAV: 5 -0.359845824627E+03 -0.15522E-04 -0.16655E-04 65832 0.474E-02 0.174E-02
DAV: 6 -0.359845825429E+03 -0.80175E-06 -0.23641E-05 53259 0.156E-02
460 F= -.35984583E+03 E0= -.35984980E+03 d E =-.329111E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359845396335E+03 0.42829E-03 -0.53343E-01 57720 0.236E+00 0.144E-01
DAV: 2 -0.359846306575E+03 -0.91024E-03 -0.11219E-02 63789 0.298E-01 0.948E-02
DAV: 3 -0.359846253223E+03 0.53352E-04 -0.18987E-04 69495 0.514E-02 0.532E-02
DAV: 4 -0.359846255214E+03 -0.19908E-05 -0.10143E-04 68019 0.401E-02 0.120E-02
DAV: 5 -0.359846257213E+03 -0.19987E-05 -0.19643E-05 50838 0.163E-02
461 F= -.35984626E+03 E0= -.35985023E+03 d E =-.372290E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359844931602E+03 0.13236E-02 -0.29629E+00 57720 0.554E+00 0.333E-01
DAV: 2 -0.359849943123E+03 -0.50115E-02 -0.61916E-02 64590 0.701E-01 0.224E-01
DAV: 3 -0.359849613444E+03 0.32968E-03 -0.10654E-03 69837 0.125E-01 0.126E-01
DAV: 4 -0.359849613504E+03 -0.60145E-07 -0.59676E-04 68001 0.951E-02 0.282E-02
DAV: 5 -0.359849625105E+03 -0.11601E-04 -0.11520E-04 65364 0.389E-02 0.139E-02
DAV: 6 -0.359849625626E+03 -0.52073E-06 -0.13951E-05 42351 0.123E-02
462 F= -.35984963E+03 E0= -.35985360E+03 d E =-.336841E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359849103573E+03 0.52153E-03 -0.62670E-01 57720 0.255E+00 0.153E-01
DAV: 2 -0.359850158245E+03 -0.10547E-02 -0.13039E-02 64644 0.322E-01 0.103E-01
DAV: 3 -0.359850088583E+03 0.69663E-04 -0.22508E-04 70026 0.571E-02 0.571E-02
DAV: 4 -0.359850089135E+03 -0.55210E-06 -0.12255E-04 68046 0.433E-02 0.127E-02
DAV: 5 -0.359850091525E+03 -0.23901E-05 -0.23093E-05 53430 0.175E-02
463 F= -.35985009E+03 E0= -.35985406E+03 d E =-.383431E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359847591633E+03 0.24975E-02 -0.31428E+00 57720 0.571E+00 0.340E-01
DAV: 2 -0.359853057074E+03 -0.54654E-02 -0.66291E-02 63159 0.719E-01 0.235E-01
DAV: 3 -0.359852678200E+03 0.37887E-03 -0.10406E-03 69621 0.132E-01 0.135E-01
DAV: 4 -0.359852666048E+03 0.12152E-04 -0.75847E-04 68406 0.103E-01 0.294E-02
DAV: 5 -0.359852675502E+03 -0.94543E-05 -0.14604E-04 66741 0.445E-02 0.158E-02
DAV: 6 -0.359852676784E+03 -0.12813E-05 -0.16849E-05 43026 0.133E-02
464 F= -.35985268E+03 E0= -.35985665E+03 d E =-.258526E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359852452577E+03 0.22293E-03 -0.23758E-01 57738 0.157E+00 0.940E-02
DAV: 2 -0.359852871870E+03 -0.41929E-03 -0.50705E-03 63609 0.198E-01 0.649E-02
DAV: 3 -0.359852843309E+03 0.28561E-04 -0.78120E-05 69786 0.358E-02 0.369E-02
DAV: 4 -0.359852842949E+03 0.36028E-06 -0.56900E-05 66093 0.283E-02
465 F= -.35985284E+03 E0= -.35985682E+03 d E =-.275142E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359851294946E+03 0.15484E-02 -0.27907E+00 57720 0.537E+00 0.322E-01
DAV: 2 -0.359856021617E+03 -0.47267E-02 -0.57799E-02 62430 0.671E-01 0.216E-01
DAV: 3 -0.359855726095E+03 0.29552E-03 -0.92048E-04 69702 0.118E-01 0.119E-01
DAV: 4 -0.359855733459E+03 -0.73640E-05 -0.54085E-04 68451 0.894E-02 0.248E-02
DAV: 5 -0.359855742745E+03 -0.92862E-05 -0.10032E-04 64752 0.359E-02 0.134E-02
DAV: 6 -0.359855743406E+03 -0.66031E-06 -0.12373E-05 41604 0.117E-02
466 F= -.35985574E+03 E0= -.35985972E+03 d E =-.290046E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359854995764E+03 0.74698E-03 -0.10258E+00 57720 0.325E+00 0.195E-01
DAV: 2 -0.359856728168E+03 -0.17324E-02 -0.21192E-02 62664 0.407E-01 0.131E-01
DAV: 3 -0.359856618461E+03 0.10971E-03 -0.33757E-04 69801 0.708E-02 0.714E-02
DAV: 4 -0.359856621228E+03 -0.27677E-05 -0.19364E-04 68523 0.535E-02 0.148E-02
DAV: 5 -0.359856624658E+03 -0.34292E-05 -0.35681E-05 61026 0.212E-02
467 F= -.35985662E+03 E0= -.35986060E+03 d E =-.378171E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359849842039E+03 0.67792E-02 -0.40996E+00 57720 0.650E+00 0.390E-01
DAV: 2 -0.359856799665E+03 -0.69576E-02 -0.84921E-02 62502 0.814E-01 0.261E-01
DAV: 3 -0.359856359793E+03 0.43987E-03 -0.13494E-03 69747 0.142E-01 0.144E-01
DAV: 4 -0.359856364295E+03 -0.45027E-05 -0.79307E-04 68577 0.108E-01 0.302E-02
DAV: 5 -0.359856377882E+03 -0.13587E-04 -0.14839E-04 64923 0.435E-02 0.162E-02
DAV: 6 -0.359856378853E+03 -0.97045E-06 -0.18295E-05 49074 0.140E-02
468 F= -.35985638E+03 E0= -.35986035E+03 d E =-.353590E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359854411525E+03 0.19664E-02 -0.15773E+00 57720 0.403E+00 0.239E-01
DAV: 2 -0.359857019587E+03 -0.26081E-02 -0.32045E-02 62085 0.502E-01 0.162E-01
DAV: 3 -0.359856841518E+03 0.17807E-03 -0.52055E-04 69657 0.874E-02 0.881E-02
DAV: 4 -0.359856843080E+03 -0.15627E-05 -0.29134E-04 68541 0.653E-02 0.179E-02
DAV: 5 -0.359856848313E+03 -0.52324E-05 -0.53245E-05 64335 0.257E-02
469 F= -.35985685E+03 E0= -.35986082E+03 d E =-.400536E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359856667221E+03 0.17586E-03 -0.17140E+00 57720 0.419E+00 0.249E-01
DAV: 2 -0.359859510677E+03 -0.28435E-02 -0.34954E-02 60846 0.523E-01 0.169E-01
DAV: 3 -0.359859318317E+03 0.19236E-03 -0.55603E-04 69243 0.900E-02 0.929E-02
DAV: 4 -0.359859317287E+03 0.10300E-05 -0.33198E-04 68685 0.707E-02 0.192E-02
DAV: 5 -0.359859323241E+03 -0.59532E-05 -0.64996E-05 64680 0.288E-02
470 F= -.35985932E+03 E0= -.35986330E+03 d E =-.247493E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359843738846E+03 0.15578E-01 -0.11722E+01 57720 0.110E+01 0.661E-01
DAV: 2 -0.359863934001E+03 -0.20195E-01 -0.24459E-01 61134 0.138E+00 0.442E-01
DAV: 3 -0.359862616103E+03 0.13179E-02 -0.38357E-03 69324 0.238E-01 0.249E-01
DAV: 4 -0.359862591130E+03 0.24973E-04 -0.23775E-03 68685 0.189E-01 0.529E-02
DAV: 5 -0.359862632116E+03 -0.40985E-04 -0.47601E-04 65283 0.785E-02 0.282E-02
DAV: 6 -0.359862635264E+03 -0.31485E-05 -0.58206E-05 64932 0.242E-02
471 F= -.35986264E+03 E0= -.35986661E+03 d E =-.578695E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359861335639E+03 0.12965E-02 -0.30412E+00 57720 0.559E+00 0.334E-01
DAV: 2 -0.359866493250E+03 -0.51576E-02 -0.63178E-02 62844 0.704E-01 0.231E-01
DAV: 3 -0.359866121998E+03 0.37125E-03 -0.10146E-03 69558 0.125E-01 0.131E-01
DAV: 4 -0.359866104519E+03 0.17479E-04 -0.72267E-04 68730 0.101E-01 0.284E-02
DAV: 5 -0.359866113146E+03 -0.86272E-05 -0.13732E-04 67056 0.440E-02 0.154E-02
DAV: 6 -0.359866114261E+03 -0.11145E-05 -0.17036E-05 45573 0.132E-02
472 F= -.35986611E+03 E0= -.35987009E+03 d E =-.347900E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359864647653E+03 0.14655E-02 -0.14977E+00 57720 0.392E+00 0.234E-01
DAV: 2 -0.359867195413E+03 -0.25478E-02 -0.31210E-02 62808 0.494E-01 0.162E-01
DAV: 3 -0.359867009222E+03 0.18619E-03 -0.49830E-04 69603 0.876E-02 0.921E-02
DAV: 4 -0.359867000003E+03 0.92190E-05 -0.35880E-04 68766 0.712E-02 0.200E-02
DAV: 5 -0.359867004209E+03 -0.42065E-05 -0.68274E-05 65697 0.311E-02
473 F= -.35986700E+03 E0= -.35987098E+03 d E =-.436895E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359865468017E+03 0.15320E-02 -0.30647E+00 57720 0.560E+00 0.333E-01
DAV: 2 -0.359870519831E+03 -0.50518E-02 -0.62322E-02 62547 0.696E-01 0.227E-01
DAV: 3 -0.359870157955E+03 0.36188E-03 -0.10096E-03 70143 0.122E-01 0.125E-01
DAV: 4 -0.359870153471E+03 0.44839E-05 -0.62314E-04 68910 0.955E-02 0.267E-02
DAV: 5 -0.359870163240E+03 -0.97694E-05 -0.11842E-04 64752 0.391E-02 0.141E-02
DAV: 6 -0.359870164077E+03 -0.83708E-06 -0.13305E-05 41919 0.120E-02
474 F= -.35987016E+03 E0= -.35987414E+03 d E =-.315987E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359866940222E+03 0.32230E-02 -0.30651E+00 57720 0.560E+00 0.333E-01
DAV: 2 -0.359871960783E+03 -0.50206E-02 -0.62198E-02 62574 0.695E-01 0.228E-01
DAV: 3 -0.359871589061E+03 0.37172E-03 -0.10185E-03 70170 0.122E-01 0.125E-01
DAV: 4 -0.359871580466E+03 0.85957E-05 -0.62502E-04 68928 0.957E-02 0.268E-02
DAV: 5 -0.359871590414E+03 -0.99486E-05 -0.11874E-04 64716 0.391E-02 0.142E-02
DAV: 6 -0.359871591225E+03 -0.81015E-06 -0.13395E-05 42081 0.120E-02
475 F= -.35987159E+03 E0= -.35987557E+03 d E =-.458702E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359870479882E+03 0.11105E-02 -0.25750E+00 57720 0.514E+00 0.307E-01
DAV: 2 -0.359874806606E+03 -0.43267E-02 -0.53375E-02 64617 0.642E-01 0.211E-01
DAV: 3 -0.359874472044E+03 0.33456E-03 -0.86814E-04 70035 0.113E-01 0.116E-01
DAV: 4 -0.359874457292E+03 0.14752E-04 -0.50264E-04 69099 0.849E-02 0.236E-02
DAV: 5 -0.359874467678E+03 -0.10386E-04 -0.97220E-05 64185 0.331E-02 0.126E-02
DAV: 6 -0.359874467843E+03 -0.16453E-06 -0.75009E-06 38634 0.944E-03
476 F= -.35987447E+03 E0= -.35987845E+03 d E =-.287662E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359873599709E+03 0.86797E-03 -0.87440E-01 57726 0.299E+00 0.178E-01
DAV: 2 -0.359875060038E+03 -0.14603E-02 -0.18030E-02 64671 0.373E-01 0.123E-01
DAV: 3 -0.359874946809E+03 0.11323E-03 -0.29349E-04 70125 0.657E-02 0.670E-02
DAV: 4 -0.359874943042E+03 0.37675E-05 -0.16856E-04 69117 0.492E-02 0.137E-02
DAV: 5 -0.359874946501E+03 -0.34589E-05 -0.32219E-05 60441 0.191E-02
477 F= -.35987495E+03 E0= -.35987893E+03 d E =-.335528E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359873923701E+03 0.10193E-02 -0.21539E+00 57720 0.469E+00 0.278E-01
DAV: 2 -0.359877505027E+03 -0.35813E-02 -0.43944E-02 62079 0.583E-01 0.194E-01
DAV: 3 -0.359877226208E+03 0.27882E-03 -0.68646E-04 69414 0.104E-01 0.108E-01
DAV: 4 -0.359877220086E+03 0.61220E-05 -0.46362E-04 69252 0.788E-02 0.228E-02
DAV: 5 -0.359877227368E+03 -0.72822E-05 -0.87387E-05 64995 0.334E-02
478 F= -.35987723E+03 E0= -.35988121E+03 d E =-.228087E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359875939916E+03 0.12802E-02 -0.13383E+00 57720 0.370E+00 0.220E-01
DAV: 2 -0.359878183239E+03 -0.22433E-02 -0.27414E-02 62259 0.460E-01 0.153E-01
DAV: 3 -0.359878014919E+03 0.16832E-03 -0.42405E-04 69459 0.819E-02 0.848E-02
DAV: 4 -0.359878014458E+03 0.46072E-06 -0.28712E-04 69243 0.620E-02 0.180E-02
DAV: 5 -0.359878018774E+03 -0.43161E-05 -0.54105E-05 63798 0.264E-02
479 F= -.35987802E+03 E0= -.35988200E+03 d E =-.307227E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359878101690E+03 -0.87232E-04 -0.17677E+00 57720 0.425E+00 0.254E-01
DAV: 2 -0.359881006214E+03 -0.29045E-02 -0.36206E-02 63969 0.536E-01 0.174E-01
DAV: 3 -0.359880775077E+03 0.23114E-03 -0.65925E-04 69450 0.961E-02 0.952E-02
DAV: 4 -0.359880769134E+03 0.59424E-05 -0.35254E-04 69252 0.709E-02 0.209E-02
DAV: 5 -0.359880776611E+03 -0.74765E-05 -0.63585E-05 64419 0.286E-02
480 F= -.35988078E+03 E0= -.35988476E+03 d E =-.275784E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359879574611E+03 0.11945E-02 -0.12994E+00 57720 0.364E+00 0.218E-01
DAV: 2 -0.359881718895E+03 -0.21443E-02 -0.26649E-02 63960 0.460E-01 0.149E-01
DAV: 3 -0.359881550279E+03 0.16862E-03 -0.47989E-04 69576 0.822E-02 0.816E-02
DAV: 4 -0.359881547179E+03 0.31002E-05 -0.25893E-04 69234 0.608E-02 0.179E-02
DAV: 5 -0.359881552630E+03 -0.54511E-05 -0.46911E-05 63528 0.245E-02
481 F= -.35988155E+03 E0= -.35988554E+03 d E =-.353386E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359880717246E+03 0.82993E-03 -0.20378E+00 57720 0.454E+00 0.273E-01
DAV: 2 -0.359884116865E+03 -0.33996E-02 -0.41917E-02 62889 0.570E-01 0.186E-01
DAV: 3 -0.359883867954E+03 0.24891E-03 -0.70978E-04 69468 0.989E-02 0.997E-02
DAV: 4 -0.359883865549E+03 0.24053E-05 -0.36811E-04 68883 0.729E-02 0.214E-02
DAV: 5 -0.359883873388E+03 -0.78390E-05 -0.68622E-05 64707 0.282E-02
482 F= -.35988387E+03 E0= -.35988786E+03 d E =-.232076E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359882412443E+03 0.14531E-02 -0.15512E+00 57720 0.396E+00 0.238E-01
DAV: 2 -0.359884997814E+03 -0.25854E-02 -0.31829E-02 63042 0.497E-01 0.161E-01
DAV: 3 -0.359884809888E+03 0.18793E-03 -0.53401E-04 69576 0.860E-02 0.866E-02
DAV: 4 -0.359884809216E+03 0.67252E-06 -0.27929E-04 68937 0.634E-02 0.185E-02
DAV: 5 -0.359884815068E+03 -0.58527E-05 -0.52083E-05 64401 0.245E-02
483 F= -.35988482E+03 E0= -.35988880E+03 d E =-.326244E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359884455535E+03 0.35368E-03 -0.22596E+00 57720 0.479E+00 0.288E-01
DAV: 2 -0.359888255162E+03 -0.37996E-02 -0.46687E-02 63933 0.602E-01 0.198E-01
DAV: 3 -0.359887968058E+03 0.28710E-03 -0.76692E-04 69882 0.108E-01 0.108E-01
DAV: 4 -0.359887968311E+03 -0.25347E-06 -0.45581E-04 68820 0.771E-02 0.233E-02
DAV: 5 -0.359887975768E+03 -0.74568E-05 -0.81229E-05 65121 0.323E-02
484 F= -.35988798E+03 E0= -.35989197E+03 d E =-.316070E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359887208503E+03 0.75981E-03 -0.94350E-01 57720 0.309E+00 0.187E-01
DAV: 2 -0.359888801725E+03 -0.15932E-02 -0.19498E-02 63987 0.389E-01 0.128E-01
DAV: 3 -0.359888685844E+03 0.11588E-03 -0.31718E-04 70062 0.692E-02 0.695E-02
DAV: 4 -0.359888688751E+03 -0.29068E-05 -0.18815E-04 68847 0.495E-02 0.150E-02
DAV: 5 -0.359888691614E+03 -0.28633E-05 -0.32942E-05 59712 0.209E-02
485 F= -.35988869E+03 E0= -.35989268E+03 d E =-.387655E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359888105015E+03 0.58374E-03 -0.20139E+00 57720 0.451E+00 0.269E-01
DAV: 2 -0.359891420301E+03 -0.33153E-02 -0.40923E-02 62169 0.566E-01 0.184E-01
DAV: 3 -0.359891165049E+03 0.25525E-03 -0.66078E-04 68982 0.999E-02 0.991E-02
DAV: 4 -0.359891168766E+03 -0.37170E-05 -0.40327E-04 68676 0.743E-02 0.207E-02
DAV: 5 -0.359891175087E+03 -0.63207E-05 -0.73491E-05 64887 0.312E-02
486 F= -.35989118E+03 E0= -.35989517E+03 d E =-.248347E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359884147490E+03 0.70213E-02 -0.56448E+00 57720 0.755E+00 0.451E-01
DAV: 2 -0.359893512424E+03 -0.93649E-02 -0.11549E-01 62052 0.949E-01 0.309E-01
DAV: 3 -0.359892790187E+03 0.72224E-03 -0.18681E-03 69036 0.169E-01 0.168E-01
DAV: 4 -0.359892795405E+03 -0.52181E-05 -0.11545E-03 68658 0.126E-01 0.355E-02
DAV: 5 -0.359892814035E+03 -0.18630E-04 -0.21332E-04 64959 0.531E-02 0.176E-02
DAV: 6 -0.359892815600E+03 -0.15652E-05 -0.18237E-05 43179 0.145E-02
487 F= -.35989282E+03 E0= -.35989681E+03 d E =-.412399E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359893175898E+03 -0.36186E-03 -0.86918E-01 57720 0.296E+00 0.177E-01
DAV: 2 -0.359894611812E+03 -0.14359E-02 -0.17737E-02 61161 0.372E-01 0.120E-01
DAV: 3 -0.359894503562E+03 0.10825E-03 -0.27981E-04 69126 0.635E-02 0.642E-02
DAV: 4 -0.359894506677E+03 -0.31146E-05 -0.16797E-04 68739 0.489E-02 0.133E-02
DAV: 5 -0.359894509348E+03 -0.26708E-05 -0.30737E-05 59235 0.199E-02
488 F= -.35989451E+03 E0= -.35989851E+03 d E =-.169375E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359885630275E+03 0.88764E-02 -0.78083E+00 57720 0.887E+00 0.533E-01
DAV: 2 -0.359898714049E+03 -0.13084E-01 -0.16124E-01 60879 0.112E+00 0.362E-01
DAV: 3 -0.359897729989E+03 0.98406E-03 -0.25505E-03 69135 0.193E-01 0.198E-01
DAV: 4 -0.359897739263E+03 -0.92744E-05 -0.15800E-03 68712 0.150E-01 0.421E-02
DAV: 5 -0.359897764539E+03 -0.25276E-04 -0.29998E-04 65004 0.627E-02 0.209E-02
DAV: 6 -0.359897767214E+03 -0.26749E-05 -0.33064E-05 60018 0.182E-02
489 F= -.35989777E+03 E0= -.35990177E+03 d E =-.495161E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359844986952E+03 0.52778E-01 -0.31170E+01 57720 0.177E+01 0.109E+00
DAV: 2 -0.359900225077E+03 -0.55238E-01 -0.67332E-01 60918 0.227E+00 0.731E-01
DAV: 3 -0.359896068274E+03 0.41568E-02 -0.10867E-02 69189 0.397E-01 0.420E-01
DAV: 4 -0.359895858791E+03 0.20948E-03 -0.68673E-03 68658 0.316E-01 0.943E-02
DAV: 5 -0.359895985333E+03 -0.12654E-03 -0.13757E-03 65463 0.134E-01 0.451E-02
DAV: 6 -0.359895997472E+03 -0.12139E-04 -0.15834E-04 66201 0.398E-02 0.255E-02
DAV: 7 -0.359895993968E+03 0.35033E-05 -0.19224E-05 50100 0.223E-02
490 F= -.35989599E+03 E0= -.35990001E+03 d E =-.317837E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359877332406E+03 0.18665E-01 -0.13790E+01 57720 0.118E+01 0.703E-01
DAV: 2 -0.359900182944E+03 -0.22851E-01 -0.28008E-01 60408 0.148E+00 0.480E-01
DAV: 3 -0.359898375336E+03 0.18076E-02 -0.45770E-03 68991 0.253E-01 0.257E-01
DAV: 4 -0.359898357659E+03 0.17677E-04 -0.25611E-03 68766 0.192E-01 0.513E-02
DAV: 5 -0.359898405103E+03 -0.47444E-04 -0.49412E-04 64869 0.762E-02 0.276E-02
DAV: 6 -0.359898409071E+03 -0.39676E-05 -0.53190E-05 66345 0.238E-02
491 F= -.35989841E+03 E0= -.35990242E+03 d E =-.559347E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359898565183E+03 -0.16008E-03 -0.15217E+00 57720 0.391E+00 0.231E-01
DAV: 2 -0.359901004553E+03 -0.24394E-02 -0.30439E-02 60021 0.487E-01 0.160E-01
DAV: 3 -0.359900810701E+03 0.19385E-03 -0.47612E-04 68865 0.851E-02 0.865E-02
DAV: 4 -0.359900817119E+03 -0.64187E-05 -0.30998E-04 68718 0.649E-02 0.183E-02
DAV: 5 -0.359900821308E+03 -0.41882E-05 -0.55356E-05 64833 0.274E-02
492 F= -.35990082E+03 E0= -.35990483E+03 d E =-.241224E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359884379828E+03 0.16437E-01 -0.13690E+01 57720 0.117E+01 0.711E-01
DAV: 2 -0.359907408216E+03 -0.23028E-01 -0.28340E-01 60339 0.148E+00 0.482E-01
DAV: 3 -0.359905683478E+03 0.17247E-02 -0.44780E-03 69009 0.260E-01 0.269E-01
DAV: 4 -0.359905716925E+03 -0.33447E-04 -0.29282E-03 68748 0.201E-01 0.593E-02
DAV: 5 -0.359905761463E+03 -0.44538E-04 -0.53998E-04 66111 0.861E-02 0.298E-02
DAV: 6 -0.359905767181E+03 -0.57183E-05 -0.65700E-05 64842 0.252E-02
493 F= -.35990577E+03 E0= -.35990978E+03 d E =-.735811E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359811483782E+03 0.94278E-01 -0.54597E+01 57720 0.234E+01 0.149E+00
DAV: 2 -0.359913152378E+03 -0.10167E+00 -0.12273E+00 60534 0.305E+00 0.984E-01
DAV: 3 -0.359905640702E+03 0.75117E-02 -0.20209E-02 69333 0.546E-01 0.589E-01
DAV: 4 -0.359904948981E+03 0.69172E-03 -0.13476E-02 68604 0.433E-01 0.141E-01
DAV: 5 -0.359905205852E+03 -0.25687E-03 -0.25698E-03 67461 0.189E-01 0.640E-02
DAV: 6 -0.359905236005E+03 -0.30153E-04 -0.33897E-04 65886 0.572E-02 0.357E-02
DAV: 7 -0.359905234974E+03 0.10309E-05 -0.41117E-05 61395 0.281E-02
494 F= -.35990523E+03 E0= -.35990926E+03 d E =-.682590E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359883431505E+03 0.21804E-01 -0.15475E+01 57720 0.125E+01 0.745E-01
DAV: 2 -0.359909231474E+03 -0.25800E-01 -0.31605E-01 60006 0.157E+00 0.512E-01
DAV: 3 -0.359907224100E+03 0.20074E-02 -0.50552E-03 68820 0.269E-01 0.275E-01
DAV: 4 -0.359907208991E+03 0.15109E-04 -0.29091E-03 68880 0.201E-01 0.550E-02
DAV: 5 -0.359907258302E+03 -0.49311E-04 -0.53098E-04 64923 0.807E-02 0.301E-02
DAV: 6 -0.359907262725E+03 -0.44231E-05 -0.57860E-05 65976 0.246E-02
495 F= -.35990726E+03 E0= -.35991128E+03 d E =-.885365E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359902118466E+03 0.51398E-02 -0.61874E+00 57720 0.790E+00 0.470E-01
DAV: 2 -0.359912186535E+03 -0.10068E-01 -0.12572E-01 61788 0.991E-01 0.323E-01
DAV: 3 -0.359911393271E+03 0.79326E-03 -0.20674E-03 69063 0.175E-01 0.177E-01
DAV: 4 -0.359911416540E+03 -0.23269E-04 -0.12330E-03 68838 0.132E-01 0.381E-02
DAV: 5 -0.359911441405E+03 -0.24865E-04 -0.22481E-04 65067 0.532E-02 0.196E-02
DAV: 6 -0.359911443394E+03 -0.19890E-05 -0.23553E-05 53457 0.158E-02
496 F= -.35991144E+03 E0= -.35991546E+03 d E =-.418067E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359903618115E+03 0.78233E-02 -0.63647E+00 57720 0.802E+00 0.480E-01
DAV: 2 -0.359914075078E+03 -0.10457E-01 -0.13012E-01 61977 0.101E+00 0.328E-01
DAV: 3 -0.359913277158E+03 0.79792E-03 -0.21360E-03 69189 0.178E-01 0.179E-01
DAV: 4 -0.359913310582E+03 -0.33424E-04 -0.12614E-03 68838 0.134E-01 0.389E-02
DAV: 5 -0.359913336437E+03 -0.25855E-04 -0.23176E-04 65094 0.539E-02 0.202E-02
DAV: 6 -0.359913338452E+03 -0.20150E-05 -0.24472E-05 54123 0.161E-02
497 F= -.35991334E+03 E0= -.35991736E+03 d E =-.607573E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359912669972E+03 0.66647E-03 -0.51645E-01 57726 0.228E+00 0.136E-01
DAV: 2 -0.359913512190E+03 -0.84222E-03 -0.10467E-02 62385 0.286E-01 0.930E-02
DAV: 3 -0.359913449327E+03 0.62863E-04 -0.17074E-04 69258 0.500E-02 0.499E-02
DAV: 4 -0.359913452979E+03 -0.36520E-05 -0.97138E-05 68901 0.371E-02
498 F= -.35991345E+03 E0= -.35991747E+03 d E =-.619025E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359913229560E+03 0.21977E-03 -0.13203E-01 57729 0.115E+00 0.666E-02
DAV: 2 -0.359913439118E+03 -0.20956E-03 -0.26546E-03 61131 0.144E-01 0.470E-02
DAV: 3 -0.359913419992E+03 0.19126E-04 -0.44366E-05 66417 0.252E-02 0.250E-02
DAV: 4 -0.359913419181E+03 0.81167E-06 -0.24008E-05 54159 0.185E-02
499 F= -.35991342E+03 E0= -.35991744E+03 d E =-.615646E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359913391230E+03 0.28762E-04 -0.36883E-02 57738 0.611E-01 0.352E-02
DAV: 2 -0.359913449862E+03 -0.58632E-04 -0.74239E-04 60978 0.762E-02 0.248E-02
DAV: 3 -0.359913444511E+03 0.53505E-05 -0.11102E-05 48858 0.133E-02
500 F= -.35991344E+03 E0= -.35991747E+03 d E =-.618179E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359912776802E+03 0.67306E-03 -0.22999E+00 57720 0.484E+00 0.289E-01
DAV: 2 -0.359916490001E+03 -0.37132E-02 -0.46477E-02 62430 0.609E-01 0.197E-01
DAV: 3 -0.359916187946E+03 0.30206E-03 -0.79689E-04 69153 0.108E-01 0.107E-01
DAV: 4 -0.359916198135E+03 -0.10189E-04 -0.45424E-04 69054 0.811E-02 0.227E-02
DAV: 5 -0.359916207174E+03 -0.90398E-05 -0.83451E-05 64437 0.318E-02
501 F= -.35991621E+03 E0= -.35992023E+03 d E =-.276266E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359914317495E+03 0.18806E-02 -0.18053E+00 57720 0.428E+00 0.256E-01
DAV: 2 -0.359917283807E+03 -0.29663E-02 -0.36805E-02 62529 0.541E-01 0.174E-01
DAV: 3 -0.359917050950E+03 0.23286E-03 -0.61122E-04 69261 0.947E-02 0.946E-02
DAV: 4 -0.359917059377E+03 -0.84272E-05 -0.35434E-04 69072 0.717E-02 0.198E-02
DAV: 5 -0.359917066457E+03 -0.70797E-05 -0.66880E-05 64257 0.283E-02
502 F= -.35991707E+03 E0= -.35992109E+03 d E =-.362195E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359916088931E+03 0.97045E-03 -0.24982E+00 57720 0.506E+00 0.300E-01
DAV: 2 -0.359920157333E+03 -0.40684E-02 -0.50443E-02 63735 0.635E-01 0.207E-01
DAV: 3 -0.359919837782E+03 0.31955E-03 -0.83581E-04 69819 0.116E-01 0.114E-01
DAV: 4 -0.359919856543E+03 -0.18761E-04 -0.51976E-04 69099 0.854E-02 0.240E-02
DAV: 5 -0.359919865680E+03 -0.91367E-05 -0.98027E-05 64572 0.351E-02
503 F= -.35991987E+03 E0= -.35992389E+03 d E =-.279922E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359918677014E+03 0.11795E-02 -0.13275E+00 57720 0.369E+00 0.220E-01
DAV: 2 -0.359920848769E+03 -0.21718E-02 -0.26848E-02 63861 0.463E-01 0.151E-01
DAV: 3 -0.359920683234E+03 0.16554E-03 -0.44088E-04 69900 0.839E-02 0.832E-02
DAV: 4 -0.359920695323E+03 -0.12089E-04 -0.27575E-04 69153 0.623E-02 0.175E-02
DAV: 5 -0.359920699877E+03 -0.45549E-05 -0.52162E-05 63708 0.259E-02
504 F= -.35992070E+03 E0= -.35992473E+03 d E =-.363342E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359920566443E+03 0.12888E-03 -0.11888E-01 57756 0.110E+00 0.664E-02
DAV: 2 -0.359920764349E+03 -0.19791E-03 -0.24157E-03 64041 0.139E-01 0.450E-02
DAV: 3 -0.359920750508E+03 0.13841E-04 -0.38155E-05 64113 0.249E-02 0.247E-02
DAV: 4 -0.359920751947E+03 -0.14397E-05 -0.24451E-05 55374 0.188E-02
505 F= -.35992075E+03 E0= -.35992478E+03 d E =-.368549E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359919975760E+03 0.77475E-03 -0.19564E+00 57720 0.447E+00 0.267E-01
DAV: 2 -0.359923105739E+03 -0.31300E-02 -0.39220E-02 63564 0.559E-01 0.182E-01
DAV: 3 -0.359922863810E+03 0.24193E-03 -0.67608E-04 69711 0.101E-01 0.987E-02
DAV: 4 -0.359922879714E+03 -0.15904E-04 -0.38637E-04 69090 0.730E-02 0.209E-02
DAV: 5 -0.359922886750E+03 -0.70367E-05 -0.68395E-05 64653 0.290E-02
506 F= -.35992289E+03 E0= -.35992692E+03 d E =-.213480E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359922659223E+03 0.22049E-03 -0.41546E-01 57726 0.206E+00 0.124E-01
DAV: 2 -0.359923333131E+03 -0.67391E-03 -0.83398E-03 63870 0.258E-01 0.835E-02
DAV: 3 -0.359923285059E+03 0.48072E-04 -0.13996E-04 69981 0.461E-02 0.452E-02
DAV: 4 -0.359923289562E+03 -0.45034E-05 -0.79811E-05 69189 0.332E-02
507 F= -.35992329E+03 E0= -.35992732E+03 d E =-.253761E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359923786640E+03 -0.50158E-03 -0.88860E-01 57720 0.304E+00 0.187E-01
DAV: 2 -0.359925241001E+03 -0.14544E-02 -0.18426E-02 64194 0.393E-01 0.125E-01
DAV: 3 -0.359925129306E+03 0.11170E-03 -0.38113E-04 70341 0.726E-02 0.688E-02
DAV: 4 -0.359925128633E+03 0.67295E-06 -0.18405E-04 68820 0.511E-02 0.163E-02
DAV: 5 -0.359925132265E+03 -0.36320E-05 -0.32010E-05 55806 0.218E-02
508 F= -.35992513E+03 E0= -.35992916E+03 d E =-.184270E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359925185663E+03 -0.57030E-04 -0.98483E-02 57744 0.101E+00 0.627E-02
DAV: 2 -0.359925351532E+03 -0.16587E-03 -0.20592E-03 64266 0.131E-01 0.415E-02
DAV: 3 -0.359925340039E+03 0.11493E-04 -0.40126E-05 64554 0.238E-02 0.227E-02
DAV: 4 -0.359925340332E+03 -0.29295E-06 -0.19779E-05 52575 0.170E-02
509 F= -.35992534E+03 E0= -.35992937E+03 d E =-.205077E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359925875868E+03 -0.53583E-03 -0.75060E-01 57720 0.279E+00 0.172E-01
DAV: 2 -0.359927106026E+03 -0.12302E-02 -0.15315E-02 64437 0.360E-01 0.115E-01
DAV: 3 -0.359927017484E+03 0.88542E-04 -0.30667E-04 70098 0.688E-02 0.640E-02
DAV: 4 -0.359927020384E+03 -0.28994E-05 -0.16619E-04 68820 0.491E-02 0.158E-02
DAV: 5 -0.359927022674E+03 -0.22907E-05 -0.27087E-05 53394 0.199E-02
510 F= -.35992702E+03 E0= -.35993106E+03 d E =-.168234E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359927037613E+03 -0.17229E-04 -0.24884E-01 57720 0.161E+00 0.995E-02
DAV: 2 -0.359927452875E+03 -0.41526E-03 -0.51069E-03 64626 0.207E-01 0.662E-02
DAV: 3 -0.359927424501E+03 0.28374E-04 -0.98897E-05 70314 0.393E-02 0.369E-02
DAV: 4 -0.359927425862E+03 -0.13611E-05 -0.54483E-05 66579 0.282E-02
511 F= -.35992743E+03 E0= -.35993146E+03 d E =-.208553E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359928298562E+03 -0.87406E-03 -0.48347E-01 57720 0.224E+00 0.138E-01
DAV: 2 -0.359929058292E+03 -0.75973E-03 -0.93724E-03 64014 0.283E-01 0.900E-02
DAV: 3 -0.359929008496E+03 0.49796E-04 -0.16925E-04 70710 0.519E-02 0.489E-02
DAV: 4 -0.359929014254E+03 -0.57582E-05 -0.10256E-04 68838 0.383E-02 0.117E-02
DAV: 5 -0.359929014623E+03 -0.36845E-06 -0.16648E-05 45321 0.166E-02
512 F= -.35992901E+03 E0= -.35993305E+03 d E =-.158876E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359924495903E+03 0.45184E-02 -0.43383E+00 57720 0.671E+00 0.413E-01
DAV: 2 -0.359931399026E+03 -0.69031E-02 -0.85264E-02 63942 0.852E-01 0.269E-01
DAV: 3 -0.359930925323E+03 0.47370E-03 -0.15376E-03 70629 0.156E-01 0.148E-01
DAV: 4 -0.359930965653E+03 -0.40330E-04 -0.94402E-04 68793 0.116E-01 0.357E-02
DAV: 5 -0.359930970992E+03 -0.53394E-05 -0.16755E-04 66921 0.508E-02 0.176E-02
DAV: 6 -0.359930972179E+03 -0.11866E-05 -0.23358E-05 46878 0.158E-02
513 F= -.35993097E+03 E0= -.35993501E+03 d E =-.354632E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359931495638E+03 -0.52465E-03 -0.28467E-01 57720 0.172E+00 0.104E-01
DAV: 2 -0.359931932362E+03 -0.43672E-03 -0.53877E-03 62160 0.214E-01 0.681E-02
DAV: 3 -0.359931902810E+03 0.29551E-04 -0.94493E-05 70215 0.391E-02 0.363E-02
DAV: 4 -0.359931905814E+03 -0.30034E-05 -0.56160E-05 68775 0.279E-02
514 F= -.35993191E+03 E0= -.35993594E+03 d E =-.933635E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359930289516E+03 0.16133E-02 -0.25598E+00 57720 0.515E+00 0.311E-01
DAV: 2 -0.359934217041E+03 -0.39275E-02 -0.48491E-02 62007 0.643E-01 0.205E-01
DAV: 3 -0.359933942927E+03 0.27411E-03 -0.84920E-04 70143 0.119E-01 0.111E-01
DAV: 4 -0.359933967173E+03 -0.24246E-04 -0.53342E-04 68784 0.857E-02 0.254E-02
DAV: 5 -0.359933971190E+03 -0.40170E-05 -0.97214E-05 67263 0.380E-02
515 F= -.35993397E+03 E0= -.35993801E+03 d E =-.299901E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359919709267E+03 0.14258E-01 -0.10213E+01 57720 0.103E+01 0.626E-01
DAV: 2 -0.359935875001E+03 -0.16166E-01 -0.19808E-01 61953 0.129E+00 0.410E-01
DAV: 3 -0.359934723781E+03 0.11512E-02 -0.34602E-03 70242 0.240E-01 0.228E-01
DAV: 4 -0.359934787441E+03 -0.63660E-04 -0.22590E-03 68739 0.177E-01 0.532E-02
DAV: 5 -0.359934804013E+03 -0.16572E-04 -0.41459E-04 67668 0.793E-02 0.264E-02
DAV: 6 -0.359934807096E+03 -0.30830E-05 -0.49663E-05 64653 0.222E-02
516 F= -.35993481E+03 E0= -.35993885E+03 d E =-.383492E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359933321108E+03 0.14829E-02 -0.12083E+00 57720 0.354E+00 0.210E-01
DAV: 2 -0.359935137764E+03 -0.18167E-02 -0.22538E-02 61437 0.438E-01 0.140E-01
DAV: 3 -0.359935003451E+03 0.13431E-03 -0.40057E-04 69855 0.801E-02 0.748E-02
DAV: 4 -0.359935011631E+03 -0.81802E-05 -0.23459E-04 68766 0.570E-02 0.164E-02
DAV: 5 -0.359935013746E+03 -0.21151E-05 -0.42052E-05 62547 0.246E-02
517 F= -.35993501E+03 E0= -.35993905E+03 d E =-.404157E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359936052273E+03 -0.10406E-02 -0.10887E+00 57720 0.337E+00 0.202E-01
DAV: 2 -0.359937672073E+03 -0.16198E-02 -0.20421E-02 62199 0.418E-01 0.136E-01
DAV: 3 -0.359937538845E+03 0.13323E-03 -0.40363E-04 69693 0.820E-02 0.738E-02
DAV: 4 -0.359937539794E+03 -0.94862E-06 -0.21908E-04 68991 0.555E-02 0.173E-02
DAV: 5 -0.359937543013E+03 -0.32190E-05 -0.35229E-05 60567 0.218E-02
518 F= -.35993754E+03 E0= -.35994158E+03 d E =-.252927E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359934767124E+03 0.27727E-02 -0.32388E+00 57720 0.580E+00 0.352E-01
DAV: 2 -0.359939707768E+03 -0.49406E-02 -0.61469E-02 62394 0.723E-01 0.235E-01
DAV: 3 -0.359939328815E+03 0.37895E-03 -0.11827E-03 69909 0.141E-01 0.129E-01
DAV: 4 -0.359939339656E+03 -0.10842E-04 -0.66075E-04 68928 0.963E-02 0.303E-02
DAV: 5 -0.359939348978E+03 -0.93217E-05 -0.10882E-04 66840 0.383E-02 0.156E-02
DAV: 6 -0.359939349227E+03 -0.24850E-06 -0.13048E-05 41487 0.120E-02
519 F= -.35993935E+03 E0= -.35994339E+03 d E =-.433548E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359940174090E+03 -0.82511E-03 -0.15566E+00 57720 0.404E+00 0.245E-01
DAV: 2 -0.359942492070E+03 -0.23180E-02 -0.29099E-02 63123 0.501E-01 0.161E-01
DAV: 3 -0.359942320341E+03 0.17173E-03 -0.54834E-04 69999 0.940E-02 0.874E-02
DAV: 4 -0.359942330915E+03 -0.10574E-04 -0.31078E-04 69279 0.675E-02 0.201E-02
DAV: 5 -0.359942333720E+03 -0.28047E-05 -0.52611E-05 64140 0.279E-02
520 F= -.35994233E+03 E0= -.35994638E+03 d E =-.298449E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359936633905E+03 0.56970E-02 -0.57082E+00 57720 0.774E+00 0.472E-01
DAV: 2 -0.359945297931E+03 -0.86640E-02 -0.10805E-01 63231 0.964E-01 0.308E-01
DAV: 3 -0.359944651889E+03 0.64604E-03 -0.20216E-03 70161 0.182E-01 0.170E-01
DAV: 4 -0.359944680618E+03 -0.28728E-04 -0.11903E-03 69252 0.132E-01 0.397E-02
DAV: 5 -0.359944690830E+03 -0.10212E-04 -0.20628E-04 67137 0.556E-02 0.206E-02
DAV: 6 -0.359944691551E+03 -0.72110E-06 -0.30680E-05 56157 0.177E-02
521 F= -.35994469E+03 E0= -.35994874E+03 d E =-.534232E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359944650909E+03 0.39921E-04 -0.21603E+00 57720 0.478E+00 0.292E-01
DAV: 2 -0.359947881301E+03 -0.32304E-02 -0.40733E-02 64230 0.595E-01 0.195E-01
DAV: 3 -0.359947633039E+03 0.24826E-03 -0.81194E-04 70656 0.116E-01 0.109E-01
DAV: 4 -0.359947646333E+03 -0.13293E-04 -0.47090E-04 69207 0.823E-02 0.258E-02
DAV: 5 -0.359947650546E+03 -0.42130E-05 -0.83554E-05 66138 0.363E-02
522 F= -.35994765E+03 E0= -.35995170E+03 d E =-.295899E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359946843277E+03 0.80306E-03 -0.11795E+00 57720 0.353E+00 0.217E-01
DAV: 2 -0.359948621196E+03 -0.17779E-02 -0.22237E-02 64473 0.439E-01 0.144E-01
DAV: 3 -0.359948491432E+03 0.12976E-03 -0.43484E-04 70692 0.850E-02 0.807E-02
DAV: 4 -0.359948501378E+03 -0.99457E-05 -0.25258E-04 69180 0.602E-02 0.189E-02
DAV: 5 -0.359948503415E+03 -0.20365E-05 -0.44519E-05 62979 0.266E-02
523 F= -.35994850E+03 E0= -.35995255E+03 d E =-.381186E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359949479040E+03 -0.97766E-03 -0.62854E-01 57720 0.259E+00 0.162E-01
DAV: 2 -0.359950441663E+03 -0.96262E-03 -0.12378E-02 66804 0.331E-01 0.108E-01
DAV: 3 -0.359950361559E+03 0.80104E-04 -0.31237E-04 70836 0.668E-02 0.605E-02
DAV: 4 -0.359950360107E+03 0.14520E-05 -0.12772E-04 68712 0.426E-02 0.156E-02
DAV: 5 -0.359950362354E+03 -0.22478E-05 -0.22610E-05 51774 0.189E-02
524 F= -.35995036E+03 E0= -.35995441E+03 d E =-.185894E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359950256555E+03 0.10355E-03 -0.41491E-01 57720 0.211E+00 0.131E-01
DAV: 2 -0.359950890374E+03 -0.63382E-03 -0.81359E-03 66741 0.268E-01 0.873E-02
DAV: 3 -0.359950837243E+03 0.53130E-04 -0.20427E-04 70836 0.541E-02 0.490E-02
DAV: 4 -0.359950836263E+03 0.98053E-06 -0.83600E-05 68739 0.344E-02
525 F= -.35995084E+03 E0= -.35995488E+03 d E =-.233285E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359951686475E+03 -0.84923E-03 -0.59135E-01 57720 0.252E+00 0.157E-01
DAV: 2 -0.359952586730E+03 -0.90025E-03 -0.11191E-02 65517 0.310E-01 0.105E-01
DAV: 3 -0.359952518021E+03 0.68709E-04 -0.22080E-04 71196 0.629E-02 0.595E-02
DAV: 4 -0.359952522826E+03 -0.48047E-05 -0.13036E-04 68442 0.425E-02 0.143E-02
DAV: 5 -0.359952523321E+03 -0.49504E-06 -0.21864E-05 51774 0.196E-02
526 F= -.35995252E+03 E0= -.35995657E+03 d E =-.168706E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359952782499E+03 -0.25967E-03 -0.36056E-01 57720 0.197E+00 0.122E-01
DAV: 2 -0.359953335106E+03 -0.55261E-03 -0.68588E-03 65427 0.242E-01 0.820E-02
DAV: 3 -0.359953293381E+03 0.41725E-04 -0.13480E-04 70944 0.487E-02 0.461E-02
DAV: 4 -0.359953296196E+03 -0.28147E-05 -0.78105E-05 68478 0.330E-02
527 F= -.35995330E+03 E0= -.35995735E+03 d E =-.245993E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359951357842E+03 0.19355E-02 -0.14442E+00 57720 0.394E+00 0.245E-01
DAV: 2 -0.359953569470E+03 -0.22116E-02 -0.27546E-02 65436 0.486E-01 0.165E-01
DAV: 3 -0.359953395729E+03 0.17374E-03 -0.54644E-04 71007 0.989E-02 0.934E-02
DAV: 4 -0.359953405425E+03 -0.96964E-05 -0.32712E-04 68370 0.673E-02 0.225E-02
DAV: 5 -0.359953407146E+03 -0.17214E-05 -0.58746E-05 64743 0.312E-02
528 F= -.35995341E+03 E0= -.35995746E+03 d E =-.257088E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359953074393E+03 0.33103E-03 -0.37627E-01 57720 0.201E+00 0.123E-01
DAV: 2 -0.359953637616E+03 -0.56322E-03 -0.71906E-03 64959 0.248E-01 0.844E-02
DAV: 3 -0.359953588943E+03 0.48673E-04 -0.14536E-04 70827 0.501E-02 0.477E-02
DAV: 4 -0.359953590329E+03 -0.13861E-05 -0.86132E-05 68595 0.346E-02
529 F= -.35995359E+03 E0= -.35995764E+03 d E =-.275407E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359954728906E+03 -0.11400E-02 -0.42762E-01 57720 0.214E+00 0.131E-01
DAV: 2 -0.359955353814E+03 -0.62491E-03 -0.78657E-03 65418 0.261E-01 0.891E-02
DAV: 3 -0.359955300039E+03 0.53775E-04 -0.15950E-04 71250 0.524E-02 0.496E-02
DAV: 4 -0.359955299133E+03 0.90644E-06 -0.88241E-05 68667 0.360E-02
530 F= -.35995530E+03 E0= -.35995935E+03 d E =-.170880E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359955439601E+03 -0.13956E-03 -0.11512E+00 57720 0.352E+00 0.219E-01
DAV: 2 -0.359957146801E+03 -0.17072E-02 -0.21194E-02 65976 0.428E-01 0.147E-01
DAV: 3 -0.359957010717E+03 0.13608E-03 -0.42440E-04 71565 0.875E-02 0.827E-02
DAV: 4 -0.359957013714E+03 -0.29968E-05 -0.24328E-04 68478 0.596E-02 0.192E-02
DAV: 5 -0.359957015290E+03 -0.15762E-05 -0.40623E-05 62574 0.249E-02
531 F= -.35995702E+03 E0= -.35996107E+03 d E =-.342496E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359950148284E+03 0.68654E-02 -0.45934E+00 57720 0.702E+00 0.434E-01
DAV: 2 -0.359956976556E+03 -0.68283E-02 -0.84759E-02 65769 0.855E-01 0.293E-01
DAV: 3 -0.359956425067E+03 0.55149E-03 -0.16929E-03 71358 0.173E-01 0.165E-01
DAV: 4 -0.359956429659E+03 -0.45923E-05 -0.96835E-04 68334 0.119E-01 0.381E-02
DAV: 5 -0.359956435801E+03 -0.61420E-05 -0.16178E-04 65670 0.499E-02 0.184E-02
DAV: 6 -0.359956435923E+03 -0.12127E-06 -0.24169E-05 48786 0.161E-02
532 F= -.35995644E+03 E0= -.35996049E+03 d E =-.284559E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359955096588E+03 0.13392E-02 -0.17622E+00 57720 0.435E+00 0.267E-01
DAV: 2 -0.359957633427E+03 -0.25368E-02 -0.31899E-02 65661 0.527E-01 0.181E-01
DAV: 3 -0.359957418259E+03 0.21517E-03 -0.64838E-04 71277 0.108E-01 0.101E-01
DAV: 4 -0.359957422930E+03 -0.46718E-05 -0.36757E-04 68487 0.732E-02 0.230E-02
DAV: 5 -0.359957425567E+03 -0.26364E-05 -0.62983E-05 64518 0.307E-02
533 F= -.35995743E+03 E0= -.35996148E+03 d E =-.383524E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359958357081E+03 -0.93415E-03 -0.91923E-01 57720 0.313E+00 0.192E-01
DAV: 2 -0.359959641124E+03 -0.12840E-02 -0.16479E-02 64863 0.382E-01 0.130E-01
DAV: 3 -0.359959523661E+03 0.11746E-03 -0.35073E-04 71367 0.761E-02 0.719E-02
DAV: 4 -0.359959522045E+03 0.16155E-05 -0.19477E-04 68415 0.525E-02 0.164E-02
DAV: 5 -0.359959523749E+03 -0.17038E-05 -0.31654E-05 55887 0.226E-02
534 F= -.35995952E+03 E0= -.35996358E+03 d E =-.209818E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359956926348E+03 0.25957E-02 -0.32686E+00 57720 0.591E+00 0.366E-01
DAV: 2 -0.359961624947E+03 -0.46986E-02 -0.59229E-02 65226 0.723E-01 0.244E-01
DAV: 3 -0.359961225855E+03 0.39909E-03 -0.12198E-03 71547 0.143E-01 0.136E-01
DAV: 4 -0.359961228200E+03 -0.23452E-05 -0.69313E-04 68019 0.991E-02 0.309E-02
DAV: 5 -0.359961233978E+03 -0.57779E-05 -0.11761E-04 67830 0.429E-02 0.150E-02
DAV: 6 -0.359961233900E+03 0.78080E-07 -0.13341E-05 40794 0.123E-02
535 F= -.35996123E+03 E0= -.35996529E+03 d E =-.380833E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359962015547E+03 -0.78157E-03 -0.16276E+00 57720 0.418E+00 0.263E-01
DAV: 2 -0.359964395545E+03 -0.23800E-02 -0.30100E-02 64590 0.514E-01 0.175E-01
DAV: 3 -0.359964209254E+03 0.18629E-03 -0.62562E-04 70422 0.101E-01 0.985E-02
DAV: 4 -0.359964210618E+03 -0.13639E-05 -0.34960E-04 68280 0.701E-02 0.224E-02
DAV: 5 -0.359964211990E+03 -0.13723E-05 -0.63914E-05 68235 0.324E-02
536 F= -.35996421E+03 E0= -.35996827E+03 d E =-.297809E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359960035075E+03 0.41755E-02 -0.45051E+00 57720 0.696E+00 0.438E-01
DAV: 2 -0.359966677258E+03 -0.66422E-02 -0.83513E-02 64599 0.856E-01 0.290E-01
DAV: 3 -0.359966158327E+03 0.51893E-03 -0.17257E-03 70404 0.168E-01 0.164E-01
DAV: 4 -0.359966160169E+03 -0.18424E-05 -0.96559E-04 67956 0.116E-01 0.373E-02
DAV: 5 -0.359966163744E+03 -0.35743E-05 -0.17502E-04 69153 0.538E-02 0.177E-02
DAV: 6 -0.359966163619E+03 0.12447E-06 -0.20032E-05 46743 0.150E-02
537 F= -.35996616E+03 E0= -.35997022E+03 d E =-.492972E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359966403663E+03 -0.23992E-03 -0.19146E+00 57720 0.454E+00 0.283E-01
DAV: 2 -0.359969218995E+03 -0.28153E-02 -0.35103E-02 65130 0.549E-01 0.189E-01
DAV: 3 -0.359968994459E+03 0.22454E-03 -0.65986E-04 70926 0.106E-01 0.105E-01
DAV: 4 -0.359968992981E+03 0.14784E-05 -0.39161E-04 68082 0.746E-02 0.221E-02
DAV: 5 -0.359968993965E+03 -0.98360E-06 -0.69763E-05 65976 0.329E-02
538 F= -.35996899E+03 E0= -.35997305E+03 d E =-.283035E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359965634059E+03 0.33589E-02 -0.35250E+00 57720 0.616E+00 0.385E-01
DAV: 2 -0.359970842614E+03 -0.52086E-02 -0.64643E-02 65184 0.745E-01 0.256E-01
DAV: 3 -0.359970429360E+03 0.41325E-03 -0.12063E-03 70872 0.143E-01 0.142E-01
DAV: 4 -0.359970426831E+03 0.25292E-05 -0.72033E-04 67848 0.101E-01 0.301E-02
DAV: 5 -0.359970428390E+03 -0.15598E-05 -0.12871E-04 67254 0.447E-02 0.152E-02
DAV: 6 -0.359970428305E+03 0.85034E-07 -0.14068E-05 41838 0.126E-02
539 F= -.35997043E+03 E0= -.35997449E+03 d E =-.426469E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359969800800E+03 0.62759E-03 -0.29333E+00 57720 0.562E+00 0.347E-01
DAV: 2 -0.359974048588E+03 -0.42478E-02 -0.53107E-02 64446 0.678E-01 0.235E-01
DAV: 3 -0.359973671561E+03 0.37703E-03 -0.10332E-03 71142 0.136E-01 0.130E-01
DAV: 4 -0.359973661884E+03 0.96761E-05 -0.64048E-04 67497 0.931E-02 0.285E-02
DAV: 5 -0.359973662957E+03 -0.10722E-05 -0.10543E-04 66552 0.416E-02 0.145E-02
DAV: 6 -0.359973663182E+03 -0.22564E-06 -0.14690E-05 40848 0.128E-02
540 F= -.35997366E+03 E0= -.35997773E+03 d E =-.323488E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359972195516E+03 0.14674E-02 -0.16960E+00 57720 0.427E+00 0.264E-01
DAV: 2 -0.359974649901E+03 -0.24544E-02 -0.30700E-02 64482 0.515E-01 0.179E-01
DAV: 3 -0.359974433603E+03 0.21630E-03 -0.59741E-04 71160 0.103E-01 0.984E-02
DAV: 4 -0.359974429081E+03 0.45225E-05 -0.36960E-04 67578 0.708E-02 0.216E-02
DAV: 5 -0.359974429630E+03 -0.54982E-06 -0.60647E-05 65427 0.316E-02
541 F= -.35997443E+03 E0= -.35997850E+03 d E =-.400133E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359974124952E+03 0.30413E-03 -0.28486E+00 57720 0.553E+00 0.345E-01
DAV: 2 -0.359978173525E+03 -0.40486E-02 -0.50323E-02 62817 0.663E-01 0.230E-01
DAV: 3 -0.359977839271E+03 0.33425E-03 -0.99011E-04 69909 0.132E-01 0.125E-01
DAV: 4 -0.359977834686E+03 0.45843E-05 -0.56541E-04 68136 0.892E-02 0.266E-02
DAV: 5 -0.359977835835E+03 -0.11488E-05 -0.95104E-05 67029 0.384E-02
542 F= -.35997784E+03 E0= -.35998190E+03 d E =-.340620E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359976105066E+03 0.17296E-02 -0.23434E+00 57720 0.502E+00 0.314E-01
DAV: 2 -0.359979444214E+03 -0.33391E-02 -0.41397E-02 62961 0.601E-01 0.208E-01
DAV: 3 -0.359979173285E+03 0.27093E-03 -0.80751E-04 69954 0.120E-01 0.113E-01
DAV: 4 -0.359979170827E+03 0.24572E-05 -0.46364E-04 68118 0.808E-02 0.241E-02
DAV: 5 -0.359979171661E+03 -0.83362E-06 -0.78138E-05 66795 0.348E-02
543 F= -.35997917E+03 E0= -.35998324E+03 d E =-.474203E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359979789598E+03 -0.61877E-03 -0.24893E+00 57720 0.519E+00 0.334E-01
DAV: 2 -0.359983366711E+03 -0.35771E-02 -0.44660E-02 64005 0.634E-01 0.216E-01
DAV: 3 -0.359983104283E+03 0.26243E-03 -0.96863E-04 70350 0.124E-01 0.120E-01
DAV: 4 -0.359983110558E+03 -0.62757E-05 -0.49554E-04 66372 0.829E-02 0.271E-02
DAV: 5 -0.359983109287E+03 0.12714E-05 -0.82782E-05 69144 0.379E-02
544 F= -.35998311E+03 E0= -.35998718E+03 d E =-.393763E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359982048610E+03 0.10619E-02 -0.18270E+00 57720 0.445E+00 0.287E-01
DAV: 2 -0.359984679291E+03 -0.26307E-02 -0.32761E-02 64149 0.543E-01 0.185E-01
DAV: 3 -0.359984490048E+03 0.18924E-03 -0.70565E-04 70386 0.106E-01 0.102E-01
DAV: 4 -0.359984496354E+03 -0.63060E-05 -0.35776E-04 66201 0.703E-02 0.230E-02
DAV: 5 -0.359984495460E+03 0.89417E-06 -0.59033E-05 67641 0.320E-02
545 F= -.35998450E+03 E0= -.35998856E+03 d E =-.532380E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359984619441E+03 -0.12309E-03 -0.30896E+00 57720 0.578E+00 0.369E-01
DAV: 2 -0.359988925499E+03 -0.43061E-02 -0.53947E-02 64158 0.701E-01 0.243E-01
DAV: 3 -0.359988571390E+03 0.35411E-03 -0.11271E-03 70512 0.143E-01 0.134E-01
DAV: 4 -0.359988574664E+03 -0.32744E-05 -0.67765E-04 66939 0.965E-02 0.295E-02
DAV: 5 -0.359988573046E+03 0.16185E-05 -0.11738E-04 68658 0.450E-02 0.147E-02
DAV: 6 -0.359988573084E+03 -0.38708E-07 -0.14376E-05 42477 0.128E-02
546 F= -.35998857E+03 E0= -.35999264E+03 d E =-.407762E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359986511198E+03 0.20618E-02 -0.28881E+00 57720 0.559E+00 0.356E-01
DAV: 2 -0.359990531479E+03 -0.40203E-02 -0.50588E-02 64194 0.680E-01 0.235E-01
DAV: 3 -0.359990194257E+03 0.33722E-03 -0.10636E-03 70512 0.138E-01 0.130E-01
DAV: 4 -0.359990195785E+03 -0.15272E-05 -0.64844E-04 66912 0.946E-02 0.289E-02
DAV: 5 -0.359990194102E+03 0.16832E-05 -0.11360E-04 68658 0.443E-02 0.144E-02
DAV: 6 -0.359990194135E+03 -0.33358E-07 -0.13882E-05 42252 0.125E-02
547 F= -.35999019E+03 E0= -.35999427E+03 d E =-.569867E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359990308777E+03 -0.11468E-03 -0.28363E+00 57720 0.556E+00 0.350E-01
DAV: 2 -0.359994337849E+03 -0.40291E-02 -0.49736E-02 64302 0.669E-01 0.231E-01
DAV: 3 -0.359993984522E+03 0.35333E-03 -0.96694E-04 72069 0.133E-01 0.123E-01
DAV: 4 -0.359993977267E+03 0.72558E-05 -0.54939E-04 65850 0.862E-02 0.249E-02
DAV: 5 -0.359993977660E+03 -0.39300E-06 -0.86607E-05 65697 0.357E-02
548 F= -.35999398E+03 E0= -.35999805E+03 d E =-.378352E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359992106754E+03 0.18705E-02 -0.27878E+00 57720 0.551E+00 0.348E-01
DAV: 2 -0.359996079820E+03 -0.39731E-02 -0.48795E-02 64491 0.663E-01 0.228E-01
DAV: 3 -0.359995740356E+03 0.33946E-03 -0.93905E-04 72123 0.131E-01 0.122E-01
DAV: 4 -0.359995735779E+03 0.45771E-05 -0.53098E-04 65814 0.847E-02 0.246E-02
DAV: 5 -0.359995736029E+03 -0.25043E-06 -0.83096E-05 65544 0.349E-02
549 F= -.35999574E+03 E0= -.35999981E+03 d E =-.554189E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359995626304E+03 0.10947E-03 -0.33160E+00 57720 0.602E+00 0.385E-01
DAV: 2 -0.360000234667E+03 -0.46084E-02 -0.57776E-02 64836 0.724E-01 0.257E-01
DAV: 3 -0.359999816733E+03 0.41793E-03 -0.12619E-03 71601 0.156E-01 0.139E-01
DAV: 4 -0.359999807085E+03 0.96482E-05 -0.70932E-04 66219 0.950E-02 0.311E-02
DAV: 5 -0.359999803741E+03 0.33435E-05 -0.10454E-04 67650 0.423E-02 0.158E-02
DAV: 6 -0.359999803906E+03 -0.16522E-06 -0.16451E-05 42090 0.133E-02
550 F= -.35999980E+03 E0= -.36000388E+03 d E =-.406788E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359999357677E+03 0.44606E-03 -0.86325E-01 57720 0.307E+00 0.197E-01
DAV: 2 -0.360000555459E+03 -0.11978E-02 -0.15074E-02 65013 0.370E-01 0.131E-01
DAV: 3 -0.360000446475E+03 0.10898E-03 -0.32884E-04 71691 0.798E-02 0.710E-02
DAV: 4 -0.360000444207E+03 0.22682E-05 -0.18642E-04 66606 0.488E-02 0.159E-02
DAV: 5 -0.360000443228E+03 0.97853E-06 -0.26419E-05 53799 0.217E-02
551 F= -.36000044E+03 E0= -.36000452E+03 d E =-.470720E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.359999276800E+03 0.11674E-02 -0.38446E+00 57720 0.647E+00 0.416E-01
DAV: 2 -0.360004579010E+03 -0.53022E-02 -0.66933E-02 64545 0.781E-01 0.273E-01
DAV: 3 -0.360004113614E+03 0.46540E-03 -0.14217E-03 71169 0.157E-01 0.150E-01
DAV: 4 -0.360004094863E+03 0.18751E-04 -0.81458E-04 64446 0.105E-01 0.330E-02
DAV: 5 -0.360004090832E+03 0.40309E-05 -0.13273E-04 68217 0.480E-02 0.157E-02
DAV: 6 -0.360004090983E+03 -0.15118E-06 -0.18703E-05 45303 0.145E-02
552 F= -.36000409E+03 E0= -.36000817E+03 d E =-.364775E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360000187000E+03 0.39038E-02 -0.42001E+00 57720 0.676E+00 0.435E-01
DAV: 2 -0.360005965039E+03 -0.57780E-02 -0.73124E-02 64527 0.816E-01 0.286E-01
DAV: 3 -0.360005453109E+03 0.51193E-03 -0.15625E-03 71124 0.164E-01 0.157E-01
DAV: 4 -0.360005431463E+03 0.21646E-04 -0.89557E-04 64386 0.110E-01 0.347E-02
DAV: 5 -0.360005426928E+03 0.45350E-05 -0.14623E-04 68154 0.505E-02 0.165E-02
DAV: 6 -0.360005427098E+03 -0.17020E-06 -0.20843E-05 46374 0.152E-02
553 F= -.36000543E+03 E0= -.36000951E+03 d E =-.498387E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360004709659E+03 0.71727E-03 -0.34220E+00 57720 0.609E+00 0.396E-01
DAV: 2 -0.360009403459E+03 -0.46938E-02 -0.59317E-02 63186 0.739E-01 0.258E-01
DAV: 3 -0.360008997523E+03 0.40594E-03 -0.12944E-03 69999 0.148E-01 0.144E-01
DAV: 4 -0.360008976722E+03 0.20801E-04 -0.76211E-04 63627 0.102E-01 0.322E-02
DAV: 5 -0.360008971285E+03 0.54373E-05 -0.13378E-04 69288 0.489E-02 0.150E-02
DAV: 6 -0.360008971495E+03 -0.21042E-06 -0.18313E-05 46410 0.141E-02
554 F= -.36000897E+03 E0= -.36001305E+03 d E =-.354440E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360006919566E+03 0.20517E-02 -0.27051E+00 57720 0.542E+00 0.352E-01
DAV: 2 -0.360010628653E+03 -0.37091E-02 -0.46885E-02 63267 0.657E-01 0.230E-01
DAV: 3 -0.360010308524E+03 0.32013E-03 -0.10234E-03 69990 0.132E-01 0.128E-01
DAV: 4 -0.360010293219E+03 0.15304E-04 -0.60158E-04 63564 0.904E-02 0.286E-02
DAV: 5 -0.360010288960E+03 0.42591E-05 -0.10550E-04 69252 0.434E-02 0.134E-02
DAV: 6 -0.360010289103E+03 -0.14274E-06 -0.14231E-05 42720 0.125E-02
555 F= -.36001029E+03 E0= -.36001437E+03 d E =-.486201E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360011689193E+03 -0.14002E-02 -0.10846E+00 57726 0.345E+00 0.224E-01
DAV: 2 -0.360013209602E+03 -0.15204E-02 -0.18712E-02 63843 0.415E-01 0.147E-01
DAV: 3 -0.360013074028E+03 0.13557E-03 -0.41677E-04 69882 0.907E-02 0.806E-02
DAV: 4 -0.360013065305E+03 0.87230E-05 -0.24116E-04 64068 0.567E-02 0.184E-02
DAV: 5 -0.360013063196E+03 0.21087E-05 -0.37270E-05 60252 0.262E-02
556 F= -.36001306E+03 E0= -.36001715E+03 d E =-.277409E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360011995618E+03 0.10697E-02 -0.19135E+00 57720 0.458E+00 0.297E-01
DAV: 2 -0.360014693442E+03 -0.26978E-02 -0.33028E-02 63951 0.551E-01 0.195E-01
DAV: 3 -0.360014452903E+03 0.24054E-03 -0.73535E-04 69738 0.121E-01 0.107E-01
DAV: 4 -0.360014437196E+03 0.15707E-04 -0.42331E-04 64257 0.751E-02 0.245E-02
DAV: 5 -0.360014433748E+03 0.34485E-05 -0.66704E-05 69081 0.345E-02
557 F= -.36001443E+03 E0= -.36001852E+03 d E =-.414464E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360015648287E+03 -0.12111E-02 -0.70704E-01 57726 0.276E+00 0.179E-01
DAV: 2 -0.360016610638E+03 -0.96235E-03 -0.11863E-02 64608 0.329E-01 0.115E-01
DAV: 3 -0.360016530241E+03 0.80398E-04 -0.24506E-04 69747 0.670E-02 0.620E-02
DAV: 4 -0.360016523015E+03 0.72259E-05 -0.13953E-04 65499 0.447E-02 0.125E-02
DAV: 5 -0.360016522428E+03 0.58669E-06 -0.23336E-05 47715 0.200E-02
558 F= -.36001652E+03 E0= -.36002061E+03 d E =-.208868E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360011811968E+03 0.47110E-02 -0.63627E+00 57720 0.829E+00 0.535E-01
DAV: 2 -0.360020453685E+03 -0.86417E-02 -0.10697E-01 64491 0.987E-01 0.345E-01
DAV: 3 -0.360019678935E+03 0.77475E-03 -0.22328E-03 69495 0.202E-01 0.188E-01
DAV: 4 -0.360019587413E+03 0.91522E-04 -0.12831E-03 65400 0.135E-01 0.382E-02
DAV: 5 -0.360019583666E+03 0.37469E-05 -0.22856E-04 70089 0.605E-02 0.202E-02
DAV: 6 -0.360019583465E+03 0.20039E-06 -0.28591E-05 55599 0.169E-02
559 F= -.36001958E+03 E0= -.36002367E+03 d E =-.514972E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360021322067E+03 -0.17384E-02 -0.16211E+00 57720 0.417E+00 0.276E-01
DAV: 2 -0.360023425274E+03 -0.21032E-02 -0.27435E-02 65526 0.507E-01 0.182E-01
DAV: 3 -0.360023221990E+03 0.20328E-03 -0.67503E-04 68055 0.108E-01 0.103E-01
DAV: 4 -0.360023195214E+03 0.26776E-04 -0.39874E-04 62286 0.728E-02 0.244E-02
DAV: 5 -0.360023191747E+03 0.34664E-05 -0.66093E-05 70008 0.362E-02
560 F= -.36002319E+03 E0= -.36002728E+03 d E =-.360828E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360021437087E+03 0.17581E-02 -0.30976E+00 57720 0.576E+00 0.382E-01
DAV: 2 -0.360025472200E+03 -0.40351E-02 -0.52369E-02 65580 0.700E-01 0.251E-01
DAV: 3 -0.360025087475E+03 0.38472E-03 -0.12845E-03 67866 0.150E-01 0.142E-01
DAV: 4 -0.360025034584E+03 0.52891E-04 -0.74903E-04 62367 0.993E-02 0.336E-02
DAV: 5 -0.360025028354E+03 0.62297E-05 -0.12303E-04 72627 0.494E-02 0.145E-02
DAV: 6 -0.360025028723E+03 -0.36924E-06 -0.21884E-05 46320 0.152E-02
561 F= -.36002503E+03 E0= -.36002911E+03 d E =-.544526E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360026265658E+03 -0.12373E-02 -0.17818E+00 57720 0.438E+00 0.295E-01
DAV: 2 -0.360028601443E+03 -0.23358E-02 -0.30324E-02 63114 0.531E-01 0.190E-01
DAV: 3 -0.360028396917E+03 0.20453E-03 -0.75637E-04 67839 0.110E-01 0.106E-01
DAV: 4 -0.360028373086E+03 0.23831E-04 -0.37173E-04 61296 0.720E-02 0.248E-02
DAV: 5 -0.360028369694E+03 0.33915E-05 -0.65236E-05 70188 0.346E-02
562 F= -.36002837E+03 E0= -.36003246E+03 d E =-.334097E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360019985458E+03 0.83876E-02 -0.98540E+00 57720 0.103E+01 0.694E-01
DAV: 2 -0.360033000302E+03 -0.13015E-01 -0.16818E-01 63285 0.125E+00 0.447E-01
DAV: 3 -0.360031864299E+03 0.11360E-02 -0.41602E-03 68748 0.258E-01 0.250E-01
DAV: 4 -0.360031711345E+03 0.15295E-03 -0.20591E-03 61332 0.169E-01 0.586E-02
DAV: 5 -0.360031693322E+03 0.18023E-04 -0.36101E-04 71115 0.814E-02 0.240E-02
DAV: 6 -0.360031694212E+03 -0.89016E-06 -0.58698E-05 64131 0.240E-02
563 F= -.36003169E+03 E0= -.36003578E+03 d E =-.666549E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360033340879E+03 -0.16476E-02 -0.24766E+00 57720 0.517E+00 0.342E-01
DAV: 2 -0.360036502594E+03 -0.31617E-02 -0.40578E-02 62808 0.611E-01 0.224E-01
DAV: 3 -0.360036195280E+03 0.30731E-03 -0.89925E-04 68136 0.131E-01 0.122E-01
DAV: 4 -0.360036165123E+03 0.30157E-04 -0.53101E-04 62781 0.839E-02 0.261E-02
DAV: 5 -0.360036160996E+03 0.41265E-05 -0.90871E-05 69981 0.402E-02
564 F= -.36003616E+03 E0= -.36004025E+03 d E =-.446678E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360022302717E+03 0.13862E-01 -0.16389E+01 57720 0.133E+01 0.878E-01
DAV: 2 -0.360043370506E+03 -0.21068E-01 -0.26950E-01 62997 0.157E+00 0.575E-01
DAV: 3 -0.360041317050E+03 0.20535E-02 -0.60035E-03 68946 0.337E-01 0.315E-01
DAV: 4 -0.360041072056E+03 0.24499E-03 -0.35232E-03 62898 0.216E-01 0.675E-02
DAV: 5 -0.360041048512E+03 0.23544E-04 -0.60431E-04 69684 0.103E-01 0.313E-02
DAV: 6 -0.360041049730E+03 -0.12180E-05 -0.86852E-05 65247 0.293E-02
565 F= -.36004105E+03 E0= -.36004514E+03 d E =-.935552E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360040262155E+03 0.78636E-03 -0.52743E+00 57720 0.752E+00 0.491E-01
DAV: 2 -0.360046971407E+03 -0.67093E-02 -0.85589E-02 65211 0.886E-01 0.325E-01
DAV: 3 -0.360046263712E+03 0.70770E-03 -0.19206E-03 68739 0.192E-01 0.176E-01
DAV: 4 -0.360046179041E+03 0.84671E-04 -0.11550E-03 62349 0.123E-01 0.370E-02
DAV: 5 -0.360046172477E+03 0.65644E-05 -0.18909E-04 69531 0.566E-02 0.182E-02
DAV: 6 -0.360046172768E+03 -0.29146E-06 -0.26664E-05 53268 0.168E-02
566 F= -.36004617E+03 E0= -.36005026E+03 d E =-.512304E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360044804637E+03 0.13678E-02 -0.22830E+00 57720 0.495E+00 0.323E-01
DAV: 2 -0.360047702930E+03 -0.28983E-02 -0.36998E-02 65337 0.582E-01 0.214E-01
DAV: 3 -0.360047393807E+03 0.30912E-03 -0.82940E-04 68541 0.127E-01 0.116E-01
DAV: 4 -0.360047359078E+03 0.34728E-04 -0.50079E-04 62916 0.807E-02 0.244E-02
DAV: 5 -0.360047356096E+03 0.29825E-05 -0.82042E-05 69189 0.373E-02
567 F= -.36004736E+03 E0= -.36005145E+03 d E =-.630637E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360048111210E+03 -0.75213E-03 -0.34237E+00 57720 0.605E+00 0.404E-01
DAV: 2 -0.360052470698E+03 -0.43595E-02 -0.56194E-02 64365 0.721E-01 0.263E-01
DAV: 3 -0.360052031157E+03 0.43954E-03 -0.13946E-03 68649 0.158E-01 0.144E-01
DAV: 4 -0.360051973821E+03 0.57335E-04 -0.72415E-04 64464 0.984E-02 0.324E-02
DAV: 5 -0.360051969502E+03 0.43192E-05 -0.11357E-04 70944 0.441E-02 0.148E-02
DAV: 6 -0.360051969374E+03 0.12773E-06 -0.17466E-05 42225 0.135E-02
568 F= -.36005197E+03 E0= -.36005606E+03 d E =-.461328E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360050773551E+03 0.11960E-02 -0.20449E+00 57720 0.467E+00 0.312E-01
DAV: 2 -0.360053364694E+03 -0.25911E-02 -0.33577E-02 64428 0.557E-01 0.204E-01
DAV: 3 -0.360053099338E+03 0.26536E-03 -0.83831E-04 68541 0.123E-01 0.111E-01
DAV: 4 -0.360053064874E+03 0.34464E-04 -0.43675E-04 64743 0.764E-02 0.252E-02
DAV: 5 -0.360053062274E+03 0.25995E-05 -0.68780E-05 70503 0.343E-02
569 F= -.36005306E+03 E0= -.36005715E+03 d E =-.570618E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360052829564E+03 0.23531E-03 -0.37514E+00 57720 0.630E+00 0.428E-01
DAV: 2 -0.360057493220E+03 -0.46637E-02 -0.61420E-02 62700 0.755E-01 0.279E-01
DAV: 3 -0.360057025052E+03 0.46817E-03 -0.16295E-03 67857 0.166E-01 0.153E-01
DAV: 4 -0.360056962071E+03 0.62982E-04 -0.83536E-04 61728 0.105E-01 0.358E-02
DAV: 5 -0.360056952900E+03 0.91703E-05 -0.13319E-04 71538 0.507E-02 0.152E-02
DAV: 6 -0.360056953070E+03 -0.16952E-06 -0.23868E-05 49443 0.156E-02
570 F= -.36005695E+03 E0= -.36006104E+03 d E =-.389080E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360056302881E+03 0.65002E-03 -0.11168E+00 57720 0.344E+00 0.234E-01
DAV: 2 -0.360057684194E+03 -0.13813E-02 -0.18308E-02 63096 0.413E-01 0.152E-01
DAV: 3 -0.360057546471E+03 0.13772E-03 -0.49131E-04 67425 0.908E-02 0.839E-02
DAV: 4 -0.360057528860E+03 0.17611E-04 -0.25078E-04 63483 0.576E-02 0.198E-02
DAV: 5 -0.360057525773E+03 0.30870E-05 -0.38958E-05 61494 0.281E-02
571 F= -.36005753E+03 E0= -.36006162E+03 d E =-.446350E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360058313439E+03 -0.78458E-03 -0.28888E+00 57720 0.553E+00 0.374E-01
DAV: 2 -0.360061861260E+03 -0.35478E-02 -0.46741E-02 65679 0.657E-01 0.246E-01
DAV: 3 -0.360061480282E+03 0.38098E-03 -0.11750E-03 67749 0.144E-01 0.134E-01
DAV: 4 -0.360061432915E+03 0.47368E-04 -0.62541E-04 64176 0.898E-02 0.300E-02
DAV: 5 -0.360061428241E+03 0.46740E-05 -0.10764E-04 69270 0.435E-02 0.130E-02
DAV: 6 -0.360061428091E+03 0.15015E-06 -0.14792E-05 42927 0.126E-02
572 F= -.36006143E+03 E0= -.36006552E+03 d E =-.390232E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360060291054E+03 0.11372E-02 -0.20089E+00 57720 0.461E+00 0.312E-01
DAV: 2 -0.360062751724E+03 -0.24607E-02 -0.32556E-02 65805 0.549E-01 0.205E-01
DAV: 3 -0.360062485709E+03 0.26602E-03 -0.82144E-04 67731 0.120E-01 0.112E-01
DAV: 4 -0.360062452269E+03 0.33440E-04 -0.44268E-04 64725 0.758E-02 0.252E-02
DAV: 5 -0.360062448797E+03 0.34717E-05 -0.76997E-05 69090 0.369E-02
573 F= -.36006245E+03 E0= -.36006654E+03 d E =-.492302E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360063042857E+03 -0.59059E-03 -0.36270E+00 57720 0.619E+00 0.425E-01
DAV: 2 -0.360067496219E+03 -0.44534E-02 -0.58054E-02 66165 0.726E-01 0.277E-01
DAV: 3 -0.360066989469E+03 0.50675E-03 -0.13182E-03 70521 0.161E-01 0.145E-01
DAV: 4 -0.360066940367E+03 0.49102E-04 -0.70467E-04 64248 0.928E-02 0.304E-02
DAV: 5 -0.360066935330E+03 0.50372E-05 -0.10994E-04 67137 0.415E-02 0.141E-02
DAV: 6 -0.360066935126E+03 0.20371E-06 -0.14674E-05 41478 0.132E-02
574 F= -.36006694E+03 E0= -.36007103E+03 d E =-.448633E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360064527608E+03 0.24077E-02 -0.36953E+00 57720 0.625E+00 0.428E-01
DAV: 2 -0.360069054476E+03 -0.45269E-02 -0.59264E-02 66237 0.733E-01 0.280E-01
DAV: 3 -0.360068528742E+03 0.52573E-03 -0.13505E-03 70665 0.163E-01 0.147E-01
DAV: 4 -0.360068475554E+03 0.53187E-04 -0.73435E-04 64302 0.950E-02 0.310E-02
DAV: 5 -0.360068470261E+03 0.52934E-05 -0.11565E-04 66939 0.426E-02 0.144E-02
DAV: 6 -0.360068470069E+03 0.19191E-06 -0.15530E-05 42153 0.135E-02
575 F= -.36006847E+03 E0= -.36007256E+03 d E =-.602127E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360069977238E+03 -0.15070E-02 -0.25128E+00 57720 0.514E+00 0.355E-01
DAV: 2 -0.360072953934E+03 -0.29767E-02 -0.39359E-02 65607 0.602E-01 0.238E-01
DAV: 3 -0.360072595027E+03 0.35891E-03 -0.92214E-04 70143 0.141E-01 0.129E-01
DAV: 4 -0.360072554481E+03 0.40546E-04 -0.60640E-04 64086 0.857E-02 0.285E-02
DAV: 5 -0.360072545759E+03 0.87222E-05 -0.96511E-05 67740 0.426E-02
576 F= -.36007255E+03 E0= -.36007664E+03 d E =-.407569E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360067918672E+03 0.46358E-02 -0.70387E+00 57720 0.861E+00 0.594E-01
DAV: 2 -0.360076302654E+03 -0.83840E-02 -0.11028E-01 65562 0.101E+00 0.398E-01
DAV: 3 -0.360075313086E+03 0.98957E-03 -0.25694E-03 70080 0.234E-01 0.215E-01
DAV: 4 -0.360075198345E+03 0.11474E-03 -0.16709E-03 63465 0.142E-01 0.471E-02
DAV: 5 -0.360075175301E+03 0.23044E-04 -0.26335E-04 67965 0.701E-02 0.212E-02
DAV: 6 -0.360075176870E+03 -0.15693E-05 -0.48609E-05 63582 0.218E-02
577 F= -.36007518E+03 E0= -.36007927E+03 d E =-.670680E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360076618351E+03 -0.14431E-02 -0.24643E+00 57720 0.508E+00 0.353E-01
DAV: 2 -0.360079592854E+03 -0.29745E-02 -0.39202E-02 65751 0.600E-01 0.229E-01
DAV: 3 -0.360079249888E+03 0.34297E-03 -0.90346E-04 70098 0.130E-01 0.122E-01
DAV: 4 -0.360079216806E+03 0.33082E-04 -0.52009E-04 65238 0.807E-02 0.250E-02
DAV: 5 -0.360079212104E+03 0.47015E-05 -0.80954E-05 69261 0.367E-02
578 F= -.36007921E+03 E0= -.36008330E+03 d E =-.403523E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360076707191E+03 0.25096E-02 -0.53843E+00 57720 0.751E+00 0.521E-01
DAV: 2 -0.360083218362E+03 -0.65112E-02 -0.85442E-02 65652 0.885E-01 0.338E-01
DAV: 3 -0.360082473149E+03 0.74521E-03 -0.19577E-03 69981 0.191E-01 0.179E-01
DAV: 4 -0.360082400620E+03 0.72530E-04 -0.11167E-03 64878 0.118E-01 0.366E-02
DAV: 5 -0.360082390923E+03 0.96972E-05 -0.17246E-04 69468 0.533E-02 0.171E-02
DAV: 6 -0.360082390842E+03 0.80467E-07 -0.23968E-05 50685 0.159E-02
579 F= -.36008239E+03 E0= -.36008648E+03 d E =-.721397E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360081624834E+03 0.76609E-03 -0.10632E+00 57720 0.334E+00 0.232E-01
DAV: 2 -0.360082907373E+03 -0.12825E-02 -0.16912E-02 66165 0.394E-01 0.150E-01
DAV: 3 -0.360082760494E+03 0.14688E-03 -0.38999E-04 70809 0.853E-02 0.797E-02
DAV: 4 -0.360082746864E+03 0.13629E-04 -0.22444E-04 65157 0.532E-02 0.164E-02
DAV: 5 -0.360082744737E+03 0.21277E-05 -0.33898E-05 57741 0.240E-02
580 F= -.36008274E+03 E0= -.36008683E+03 d E =-.756787E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360083784823E+03 -0.10380E-02 -0.34617E+00 57720 0.601E+00 0.418E-01
DAV: 2 -0.360087860547E+03 -0.40757E-02 -0.54053E-02 64527 0.709E-01 0.275E-01
DAV: 3 -0.360087370919E+03 0.48963E-03 -0.13204E-03 69504 0.164E-01 0.148E-01
DAV: 4 -0.360087321358E+03 0.49561E-04 -0.81790E-04 64887 0.100E-01 0.333E-02
DAV: 5 -0.360087310469E+03 0.10889E-04 -0.12317E-04 68820 0.490E-02 0.150E-02
DAV: 6 -0.360087310828E+03 -0.35927E-06 -0.22826E-05 49335 0.155E-02
581 F= -.36008731E+03 E0= -.36009140E+03 d E =-.456609E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360085863377E+03 0.14471E-02 -0.33750E+00 57720 0.593E+00 0.413E-01
DAV: 2 -0.360089830941E+03 -0.39676E-02 -0.52781E-02 64509 0.701E-01 0.272E-01
DAV: 3 -0.360089352173E+03 0.47877E-03 -0.12953E-03 69585 0.162E-01 0.146E-01
DAV: 4 -0.360089303807E+03 0.48367E-04 -0.80781E-04 64887 0.100E-01 0.331E-02
DAV: 5 -0.360089292875E+03 0.10931E-04 -0.12247E-04 68964 0.490E-02 0.149E-02
DAV: 6 -0.360089293229E+03 -0.35348E-06 -0.22711E-05 49560 0.154E-02
582 F= -.36008929E+03 E0= -.36009338E+03 d E =-.654849E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360089139873E+03 0.15300E-03 -0.24864E-01 57720 0.161E+00 0.113E-01
DAV: 2 -0.360089433956E+03 -0.29408E-03 -0.39042E-03 64977 0.191E-01 0.739E-02
DAV: 3 -0.360089399935E+03 0.34021E-04 -0.95626E-05 69966 0.439E-02 0.398E-02
DAV: 4 -0.360089396774E+03 0.31612E-05 -0.59912E-05 64068 0.273E-02
583 F= -.36008940E+03 E0= -.36009349E+03 d E =-.665204E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360090567128E+03 -0.11672E-02 -0.25404E+00 57720 0.515E+00 0.355E-01
DAV: 2 -0.360093572340E+03 -0.30052E-02 -0.39182E-02 64995 0.601E-01 0.236E-01
DAV: 3 -0.360093200104E+03 0.37224E-03 -0.92423E-04 69522 0.143E-01 0.125E-01
DAV: 4 -0.360093162044E+03 0.38060E-04 -0.60017E-04 65202 0.860E-02 0.282E-02
DAV: 5 -0.360093153106E+03 0.89381E-05 -0.93061E-05 68289 0.423E-02
584 F= -.36009315E+03 E0= -.36009724E+03 d E =-.375633E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360093094099E+03 0.67945E-04 -0.12842E+00 57720 0.367E+00 0.252E-01
DAV: 2 -0.360094618465E+03 -0.15244E-02 -0.19760E-02 65166 0.427E-01 0.167E-01
DAV: 3 -0.360094437948E+03 0.18052E-03 -0.45888E-04 69765 0.100E-01 0.882E-02
DAV: 4 -0.360094421011E+03 0.16937E-04 -0.29564E-04 65031 0.604E-02 0.196E-02
DAV: 5 -0.360094416363E+03 0.46480E-05 -0.44810E-05 63690 0.297E-02
585 F= -.36009442E+03 E0= -.36009851E+03 d E =-.501959E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360088225232E+03 0.61958E-02 -0.51370E+00 57720 0.733E+00 0.503E-01
DAV: 2 -0.360094275964E+03 -0.60507E-02 -0.78942E-02 64959 0.853E-01 0.335E-01
DAV: 3 -0.360093528319E+03 0.74765E-03 -0.18570E-03 69369 0.201E-01 0.177E-01
DAV: 4 -0.360093453669E+03 0.74650E-04 -0.11936E-03 65139 0.121E-01 0.395E-02
DAV: 5 -0.360093436140E+03 0.17529E-04 -0.18460E-04 68820 0.596E-02 0.185E-02
DAV: 6 -0.360093437280E+03 -0.11402E-05 -0.35506E-05 58902 0.191E-02
586 F= -.36009344E+03 E0= -.36009753E+03 d E =-.404051E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360091949046E+03 0.14871E-02 -0.26673E+00 57720 0.528E+00 0.361E-01
DAV: 2 -0.360095078334E+03 -0.31293E-02 -0.40987E-02 65109 0.614E-01 0.241E-01
DAV: 3 -0.360094672250E+03 0.40608E-03 -0.96942E-04 69360 0.146E-01 0.128E-01
DAV: 4 -0.360094628101E+03 0.44149E-04 -0.63194E-04 65553 0.882E-02 0.287E-02
DAV: 5 -0.360094619104E+03 0.89969E-05 -0.98134E-05 67938 0.432E-02
587 F= -.36009462E+03 E0= -.36009871E+03 d E =-.522233E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360094961612E+03 -0.33351E-03 -0.35486E+00 57720 0.610E+00 0.415E-01
DAV: 2 -0.360099273588E+03 -0.43120E-02 -0.56588E-02 67380 0.718E-01 0.274E-01
DAV: 3 -0.360098725096E+03 0.54849E-03 -0.12384E-03 70512 0.155E-01 0.143E-01
DAV: 4 -0.360098657587E+03 0.67509E-04 -0.76513E-04 66246 0.981E-02 0.289E-02
DAV: 5 -0.360098653430E+03 0.41569E-05 -0.11712E-04 65922 0.424E-02 0.143E-02
DAV: 6 -0.360098653149E+03 0.28154E-06 -0.14971E-05 40803 0.133E-02
588 F= -.36009865E+03 E0= -.36010274E+03 d E =-.403404E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360097897766E+03 0.75566E-03 -0.14230E+00 57720 0.386E+00 0.264E-01
DAV: 2 -0.360099645364E+03 -0.17476E-02 -0.22770E-02 67713 0.455E-01 0.174E-01
DAV: 3 -0.360099432505E+03 0.21286E-03 -0.49294E-04 70854 0.978E-02 0.908E-02
DAV: 4 -0.360099407665E+03 0.24840E-04 -0.30474E-04 65868 0.621E-02 0.182E-02
DAV: 5 -0.360099405869E+03 0.17962E-05 -0.46086E-05 62718 0.268E-02
589 F= -.36009941E+03 E0= -.36010349E+03 d E =-.478676E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360099583936E+03 -0.17627E-03 -0.39501E+00 57720 0.642E+00 0.446E-01
DAV: 2 -0.360104124516E+03 -0.45406E-02 -0.61197E-02 66465 0.757E-01 0.301E-01
DAV: 3 -0.360103555968E+03 0.56855E-03 -0.16145E-03 69162 0.178E-01 0.164E-01
DAV: 4 -0.360103473181E+03 0.82786E-04 -0.95934E-04 64923 0.109E-01 0.374E-02
DAV: 5 -0.360103462800E+03 0.10382E-04 -0.14766E-04 69738 0.525E-02 0.161E-02
DAV: 6 -0.360103463146E+03 -0.34631E-06 -0.25442E-05 48570 0.162E-02
590 F= -.36010346E+03 E0= -.36010755E+03 d E =-.405728E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360103291175E+03 0.17162E-03 -0.61013E-01 57720 0.252E+00 0.176E-01
DAV: 2 -0.360103993941E+03 -0.70277E-03 -0.94905E-03 66804 0.299E-01 0.119E-01
DAV: 3 -0.360103907473E+03 0.86468E-04 -0.25035E-04 69432 0.701E-02 0.649E-02
DAV: 4 -0.360103894906E+03 0.12567E-04 -0.15111E-04 64869 0.434E-02 0.149E-02
DAV: 5 -0.360103892903E+03 0.20025E-05 -0.21817E-05 46617 0.211E-02
591 F= -.36010389E+03 E0= -.36010798E+03 d E =-.448703E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360104519351E+03 -0.62445E-03 -0.39343E+00 57720 0.642E+00 0.447E-01
DAV: 2 -0.360109020965E+03 -0.45016E-02 -0.60698E-02 66480 0.755E-01 0.294E-01
DAV: 3 -0.360108502919E+03 0.51805E-03 -0.14968E-03 71961 0.163E-01 0.158E-01
DAV: 4 -0.360108435456E+03 0.67464E-04 -0.80251E-04 65715 0.100E-01 0.337E-02
DAV: 5 -0.360108426079E+03 0.93767E-05 -0.12642E-04 69576 0.481E-02 0.141E-02
DAV: 6 -0.360108426146E+03 -0.66950E-07 -0.18731E-05 41523 0.145E-02
592 F= -.36010843E+03 E0= -.36011252E+03 d E =-.453324E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360106821639E+03 0.16044E-02 -0.28777E+00 57720 0.549E+00 0.383E-01
DAV: 2 -0.360110105911E+03 -0.32843E-02 -0.44450E-02 66615 0.647E-01 0.252E-01
DAV: 3 -0.360109727323E+03 0.37859E-03 -0.11063E-03 72006 0.140E-01 0.136E-01
DAV: 4 -0.360109677548E+03 0.49774E-04 -0.59044E-04 65760 0.863E-02 0.289E-02
DAV: 5 -0.360109670602E+03 0.69463E-05 -0.93488E-05 69729 0.413E-02
593 F= -.36010967E+03 E0= -.36011377E+03 d E =-.577770E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360110930801E+03 -0.12533E-02 -0.28926E+00 57720 0.550E+00 0.372E-01
DAV: 2 -0.360114183416E+03 -0.32526E-02 -0.42645E-02 66525 0.628E-01 0.250E-01
DAV: 3 -0.360113784999E+03 0.39842E-03 -0.93395E-04 71736 0.141E-01 0.133E-01
DAV: 4 -0.360113738718E+03 0.46281E-04 -0.61412E-04 65751 0.868E-02 0.263E-02
DAV: 5 -0.360113732512E+03 0.62062E-05 -0.96459E-05 66345 0.408E-02
594 F= -.36011373E+03 E0= -.36011783E+03 d E =-.406191E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360110803062E+03 0.29357E-02 -0.65284E+00 57720 0.826E+00 0.559E-01
DAV: 2 -0.360118143281E+03 -0.73402E-02 -0.96490E-02 66462 0.945E-01 0.375E-01
DAV: 3 -0.360117234963E+03 0.90832E-03 -0.21159E-03 71808 0.212E-01 0.201E-01
DAV: 4 -0.360117125520E+03 0.10944E-03 -0.14059E-03 65733 0.132E-01 0.397E-02
DAV: 5 -0.360117111515E+03 0.14005E-04 -0.22190E-04 66480 0.620E-02 0.188E-02
DAV: 6 -0.360117111824E+03 -0.30887E-06 -0.31915E-05 57291 0.186E-02
595 F= -.36011711E+03 E0= -.36012121E+03 d E =-.744122E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360088598152E+03 0.28513E-01 -0.26074E+01 57720 0.165E+01 0.112E+00
DAV: 2 -0.360118147766E+03 -0.29550E-01 -0.38984E-01 66390 0.190E+00 0.752E-01
DAV: 3 -0.360114424114E+03 0.37237E-02 -0.85856E-03 71736 0.425E-01 0.408E-01
DAV: 4 -0.360113921998E+03 0.50212E-03 -0.57206E-03 65868 0.267E-01 0.802E-02
DAV: 5 -0.360113874480E+03 0.47519E-04 -0.90310E-04 66633 0.124E-01 0.380E-02
DAV: 6 -0.360113875604E+03 -0.11246E-05 -0.13042E-04 67713 0.371E-02 0.192E-02
DAV: 7 -0.360113873098E+03 0.25063E-05 -0.15325E-05 40443 0.155E-02
596 F= -.36011387E+03 E0= -.36011796E+03 d E =-.420250E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360103505804E+03 0.10370E-01 -0.14560E+01 57720 0.123E+01 0.834E-01
DAV: 2 -0.360119981197E+03 -0.16475E-01 -0.21645E-01 66300 0.142E+00 0.561E-01
DAV: 3 -0.360117869030E+03 0.21122E-02 -0.47878E-03 71691 0.318E-01 0.302E-01
DAV: 4 -0.360117582330E+03 0.28670E-03 -0.31960E-03 66444 0.199E-01 0.597E-02
DAV: 5 -0.360117552356E+03 0.29974E-04 -0.50944E-04 66795 0.931E-02 0.283E-02
DAV: 6 -0.360117552706E+03 -0.34913E-06 -0.71685E-05 66579 0.276E-02
597 F= -.36011755E+03 E0= -.36012165E+03 d E =-.788210E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360117212702E+03 0.33965E-03 -0.50473E+00 57720 0.727E+00 0.489E-01
DAV: 2 -0.360122956927E+03 -0.57442E-02 -0.75632E-02 66552 0.836E-01 0.329E-01
DAV: 3 -0.360122194953E+03 0.76197E-03 -0.17656E-03 72375 0.193E-01 0.173E-01
DAV: 4 -0.360122096718E+03 0.98234E-04 -0.10679E-03 66075 0.115E-01 0.346E-02
DAV: 5 -0.360122089178E+03 0.75405E-05 -0.16365E-04 66300 0.508E-02 0.171E-02
DAV: 6 -0.360122088997E+03 0.18125E-06 -0.22029E-05 46572 0.160E-02
598 F= -.36012209E+03 E0= -.36012618E+03 d E =-.453629E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360120650672E+03 0.14385E-02 -0.24389E+00 57720 0.505E+00 0.342E-01
DAV: 2 -0.360123458971E+03 -0.28083E-02 -0.36798E-02 66840 0.583E-01 0.229E-01
DAV: 3 -0.360123095234E+03 0.36374E-03 -0.85161E-04 72429 0.134E-01 0.121E-01
DAV: 4 -0.360123049555E+03 0.45680E-04 -0.52402E-04 66039 0.806E-02 0.243E-02
DAV: 5 -0.360123045344E+03 0.42106E-05 -0.81099E-05 66291 0.361E-02
599 F= -.36012305E+03 E0= -.36012713E+03 d E =-.549264E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360122783943E+03 0.26561E-03 -0.47795E+00 57720 0.707E+00 0.485E-01
DAV: 2 -0.360128412700E+03 -0.56288E-02 -0.73971E-02 66255 0.825E-01 0.321E-01
DAV: 3 -0.360127726964E+03 0.68574E-03 -0.16780E-03 72375 0.185E-01 0.173E-01
DAV: 4 -0.360127642795E+03 0.84169E-04 -0.10077E-03 66579 0.113E-01 0.358E-02
DAV: 5 -0.360127635855E+03 0.69397E-05 -0.15468E-04 67074 0.500E-02 0.167E-02
DAV: 6 -0.360127635489E+03 0.36555E-06 -0.22242E-05 44889 0.161E-02
600 F= -.36012764E+03 E0= -.36013173E+03 d E =-.459015E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360126210803E+03 0.14251E-02 -0.25784E+00 57720 0.520E+00 0.356E-01
DAV: 2 -0.360129241731E+03 -0.30309E-02 -0.39946E-02 66336 0.606E-01 0.236E-01
DAV: 3 -0.360128867128E+03 0.37460E-03 -0.91261E-04 72474 0.136E-01 0.127E-01
DAV: 4 -0.360128820304E+03 0.46824E-04 -0.55064E-04 66642 0.838E-02 0.264E-02
DAV: 5 -0.360128816540E+03 0.37637E-05 -0.85090E-05 66912 0.371E-02
601 F= -.36012882E+03 E0= -.36013291E+03 d E =-.577120E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360127751849E+03 0.10685E-02 -0.56647E+00 57720 0.770E+00 0.529E-01
DAV: 2 -0.360134369115E+03 -0.66173E-02 -0.88624E-02 68253 0.908E-01 0.352E-01
DAV: 3 -0.360133559494E+03 0.80962E-03 -0.21890E-03 71340 0.201E-01 0.194E-01
DAV: 4 -0.360133440380E+03 0.11911E-03 -0.12667E-03 66426 0.129E-01 0.412E-02
DAV: 5 -0.360133434063E+03 0.63165E-05 -0.20381E-04 67641 0.575E-02 0.183E-02
DAV: 6 -0.360133433591E+03 0.47261E-06 -0.29949E-05 55779 0.180E-02
602 F= -.36013343E+03 E0= -.36013753E+03 d E =-.461705E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360133221560E+03 0.21250E-03 -0.50395E-01 57720 0.230E+00 0.159E-01
DAV: 2 -0.360133812911E+03 -0.59135E-03 -0.79214E-03 68307 0.272E-01 0.105E-01
DAV: 3 -0.360133741090E+03 0.71822E-04 -0.19871E-04 71295 0.604E-02 0.580E-02
DAV: 4 -0.360133730564E+03 0.10526E-04 -0.11381E-04 66534 0.388E-02 0.124E-02
DAV: 5 -0.360133729736E+03 0.82758E-06 -0.16985E-05 41847 0.174E-02
603 F= -.36013373E+03 E0= -.36013782E+03 d E =-.491320E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360134393148E+03 -0.66258E-03 -0.21797E+00 57720 0.477E+00 0.326E-01
DAV: 2 -0.360136888324E+03 -0.24952E-02 -0.33796E-02 67719 0.558E-01 0.219E-01
DAV: 3 -0.360136561665E+03 0.32666E-03 -0.81970E-04 71286 0.125E-01 0.119E-01
DAV: 4 -0.360136513807E+03 0.47858E-04 -0.49749E-04 67317 0.793E-02 0.250E-02
DAV: 5 -0.360136511222E+03 0.25847E-05 -0.79197E-05 66345 0.355E-02
604 F= -.36013651E+03 E0= -.36014061E+03 d E =-.278149E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360136325725E+03 0.18808E-03 -0.79869E-01 57720 0.289E+00 0.198E-01
DAV: 2 -0.360137253151E+03 -0.92743E-03 -0.12407E-02 67929 0.338E-01 0.132E-01
DAV: 3 -0.360137137869E+03 0.11528E-03 -0.29606E-04 71232 0.752E-02 0.719E-02
DAV: 4 -0.360137121683E+03 0.16186E-04 -0.17937E-04 67254 0.476E-02 0.150E-02
DAV: 5 -0.360137120543E+03 0.11394E-05 -0.27269E-05 50145 0.214E-02
605 F= -.36013712E+03 E0= -.36014122E+03 d E =-.339081E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360137962246E+03 -0.84056E-03 -0.27056E+00 57720 0.533E+00 0.366E-01
DAV: 2 -0.360141147555E+03 -0.31853E-02 -0.42023E-02 67206 0.621E-01 0.241E-01
DAV: 3 -0.360140740503E+03 0.40705E-03 -0.99072E-04 72303 0.139E-01 0.125E-01
DAV: 4 -0.360140696477E+03 0.44026E-04 -0.55489E-04 66939 0.823E-02 0.265E-02
DAV: 5 -0.360140691564E+03 0.49127E-05 -0.81114E-05 66732 0.356E-02
606 F= -.36014069E+03 E0= -.36014479E+03 d E =-.357102E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360140118703E+03 0.57777E-03 -0.15783E+00 57720 0.407E+00 0.280E-01
DAV: 2 -0.360141992656E+03 -0.18740E-02 -0.24551E-02 67254 0.475E-01 0.184E-01
DAV: 3 -0.360141759383E+03 0.23327E-03 -0.57366E-04 72303 0.106E-01 0.956E-02
DAV: 4 -0.360141734910E+03 0.24473E-04 -0.31975E-04 66894 0.626E-02 0.201E-02
DAV: 5 -0.360141731946E+03 0.29644E-05 -0.46250E-05 62754 0.271E-02
607 F= -.36014173E+03 E0= -.36014583E+03 d E =-.461140E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360142880571E+03 -0.11457E-02 -0.20569E+00 57720 0.462E+00 0.317E-01
DAV: 2 -0.360145174413E+03 -0.22938E-02 -0.30663E-02 67551 0.535E-01 0.216E-01
DAV: 3 -0.360144848870E+03 0.32554E-03 -0.76070E-04 71637 0.129E-01 0.116E-01
DAV: 4 -0.360144804319E+03 0.44550E-04 -0.51835E-04 67731 0.800E-02 0.247E-02
DAV: 5 -0.360144799398E+03 0.49219E-05 -0.80355E-05 66345 0.357E-02
608 F= -.36014480E+03 E0= -.36014890E+03 d E =-.306745E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360144617871E+03 0.18645E-03 -0.12670E+00 57720 0.363E+00 0.249E-01
DAV: 2 -0.360146040143E+03 -0.14223E-02 -0.18920E-02 67713 0.420E-01 0.169E-01
DAV: 3 -0.360145842366E+03 0.19778E-03 -0.46576E-04 71574 0.101E-01 0.912E-02
DAV: 4 -0.360145815522E+03 0.26844E-04 -0.32055E-04 67776 0.629E-02 0.195E-02
DAV: 5 -0.360145812313E+03 0.32090E-05 -0.49399E-05 62358 0.282E-02
609 F= -.36014581E+03 E0= -.36014991E+03 d E =-.408037E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360146969681E+03 -0.11542E-02 -0.16865E+00 57720 0.417E+00 0.288E-01
DAV: 2 -0.360148850098E+03 -0.18804E-02 -0.25586E-02 67902 0.488E-01 0.189E-01
DAV: 3 -0.360148591490E+03 0.25861E-03 -0.66363E-04 71484 0.106E-01 0.981E-02
DAV: 4 -0.360148561696E+03 0.29795E-04 -0.33133E-04 67200 0.635E-02 0.204E-02
DAV: 5 -0.360148560156E+03 0.15398E-05 -0.48987E-05 63366 0.268E-02
610 F= -.36014856E+03 E0= -.36015266E+03 d E =-.274784E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360148184539E+03 0.37716E-03 -0.11878E+00 57720 0.350E+00 0.242E-01
DAV: 2 -0.360149512348E+03 -0.13278E-02 -0.18015E-02 67974 0.409E-01 0.159E-01
DAV: 3 -0.360149331040E+03 0.18131E-03 -0.46617E-04 71448 0.890E-02 0.819E-02
DAV: 4 -0.360149310736E+03 0.20304E-04 -0.22944E-04 67245 0.528E-02 0.170E-02
DAV: 5 -0.360149309573E+03 0.11628E-05 -0.32798E-05 54330 0.221E-02
611 F= -.36014931E+03 E0= -.36015341E+03 d E =-.349726E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360150203690E+03 -0.89295E-03 -0.15505E+00 57720 0.399E+00 0.279E-01
DAV: 2 -0.360151849562E+03 -0.16459E-02 -0.22695E-02 66768 0.458E-01 0.187E-01
DAV: 3 -0.360151613230E+03 0.23633E-03 -0.58088E-04 71988 0.108E-01 0.969E-02
DAV: 4 -0.360151584321E+03 0.28909E-04 -0.32672E-04 66912 0.623E-02 0.204E-02
DAV: 5 -0.360151580842E+03 0.34795E-05 -0.51418E-05 63978 0.287E-02
612 F= -.36015158E+03 E0= -.36015569E+03 d E =-.227127E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360151410363E+03 0.17396E-03 -0.14248E+00 57720 0.382E+00 0.268E-01
DAV: 2 -0.360152929208E+03 -0.15188E-02 -0.20871E-02 66804 0.439E-01 0.179E-01
DAV: 3 -0.360152714471E+03 0.21474E-03 -0.53105E-04 71943 0.103E-01 0.931E-02
DAV: 4 -0.360152688317E+03 0.26155E-04 -0.29998E-04 66930 0.597E-02 0.195E-02
DAV: 5 -0.360152685028E+03 0.32888E-05 -0.46952E-05 61881 0.276E-02
613 F= -.36015269E+03 E0= -.36015679E+03 d E =-.337545E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360146666273E+03 0.60220E-02 -0.56983E+00 57720 0.765E+00 0.535E-01
DAV: 2 -0.360152726719E+03 -0.60604E-02 -0.83613E-02 66732 0.880E-01 0.358E-01
DAV: 3 -0.360151854289E+03 0.87243E-03 -0.21319E-03 71952 0.207E-01 0.187E-01
DAV: 4 -0.360151744753E+03 0.10954E-03 -0.12150E-03 67101 0.120E-01 0.392E-02
DAV: 5 -0.360151731749E+03 0.13004E-04 -0.19203E-04 66498 0.554E-02 0.177E-02
DAV: 6 -0.360151731654E+03 0.94806E-07 -0.28095E-05 53925 0.179E-02
614 F= -.36015173E+03 E0= -.36015584E+03 d E =-.242208E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360150097309E+03 0.16344E-02 -0.31608E+00 57720 0.569E+00 0.398E-01
DAV: 2 -0.360153404363E+03 -0.33071E-02 -0.46160E-02 66708 0.654E-01 0.266E-01
DAV: 3 -0.360152912575E+03 0.49179E-03 -0.11914E-03 71709 0.155E-01 0.139E-01
DAV: 4 -0.360152847154E+03 0.65422E-04 -0.66878E-04 66876 0.891E-02 0.292E-02
DAV: 5 -0.360152840926E+03 0.62279E-05 -0.10697E-04 66660 0.411E-02 0.131E-02
DAV: 6 -0.360152840703E+03 0.22226E-06 -0.13868E-05 40362 0.130E-02
615 F= -.36015284E+03 E0= -.36015695E+03 d E =-.353113E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360153824852E+03 -0.98393E-03 -0.25100E+00 57720 0.510E+00 0.354E-01
DAV: 2 -0.360156525133E+03 -0.27003E-02 -0.37143E-02 66570 0.583E-01 0.236E-01
DAV: 3 -0.360156110412E+03 0.41472E-03 -0.92346E-04 72042 0.137E-01 0.121E-01
DAV: 4 -0.360156063693E+03 0.46719E-04 -0.54427E-04 67614 0.812E-02 0.258E-02
DAV: 5 -0.360156058713E+03 0.49793E-05 -0.83350E-05 65805 0.358E-02
616 F= -.36015606E+03 E0= -.36016017E+03 d E =-.321801E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360154661707E+03 0.14020E-02 -0.29400E+00 57720 0.552E+00 0.384E-01
DAV: 2 -0.360157877359E+03 -0.32157E-02 -0.43707E-02 66765 0.632E-01 0.256E-01
DAV: 3 -0.360157403656E+03 0.47370E-03 -0.10706E-03 72051 0.148E-01 0.131E-01
DAV: 4 -0.360157352637E+03 0.51019E-04 -0.63526E-04 67506 0.878E-02 0.279E-02
DAV: 5 -0.360157346281E+03 0.63558E-05 -0.97668E-05 66273 0.390E-02
617 F= -.36015735E+03 E0= -.36016146E+03 d E =-.450558E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360157786892E+03 -0.43426E-03 -0.29397E+00 57720 0.552E+00 0.382E-01
DAV: 2 -0.360160991430E+03 -0.32045E-02 -0.43911E-02 68025 0.635E-01 0.255E-01
DAV: 3 -0.360160497688E+03 0.49374E-03 -0.10844E-03 71331 0.149E-01 0.129E-01
DAV: 4 -0.360160449359E+03 0.48329E-04 -0.64585E-04 67767 0.879E-02 0.281E-02
DAV: 5 -0.360160444267E+03 0.50920E-05 -0.94360E-05 66354 0.389E-02
618 F= -.36016044E+03 E0= -.36016456E+03 d E =-.309799E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360160317268E+03 0.13209E-03 -0.58843E-01 57720 0.247E+00 0.171E-01
DAV: 2 -0.360160967770E+03 -0.65050E-03 -0.87971E-03 68253 0.284E-01 0.114E-01
DAV: 3 -0.360160871736E+03 0.96034E-04 -0.21463E-04 71385 0.663E-02 0.576E-02
DAV: 4 -0.360160862906E+03 0.88301E-05 -0.12632E-04 67686 0.388E-02 0.125E-02
DAV: 5 -0.360160861730E+03 0.11760E-05 -0.16863E-05 40704 0.172E-02
619 F= -.36016086E+03 E0= -.36016498E+03 d E =-.351545E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360161803226E+03 -0.94032E-03 -0.15182E+00 57720 0.397E+00 0.280E-01
DAV: 2 -0.360163447826E+03 -0.16446E-02 -0.23040E-02 67092 0.465E-01 0.188E-01
DAV: 3 -0.360163185695E+03 0.26213E-03 -0.62935E-04 71241 0.114E-01 0.988E-02
DAV: 4 -0.360163148733E+03 0.36963E-04 -0.38045E-04 67623 0.687E-02 0.222E-02
DAV: 5 -0.360163145680E+03 0.30529E-05 -0.54969E-05 63501 0.295E-02
620 F= -.36016315E+03 E0= -.36016726E+03 d E =-.228395E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360163187727E+03 -0.38994E-04 -0.24513E-01 57720 0.160E+00 0.113E-01
DAV: 2 -0.360163461296E+03 -0.27357E-03 -0.37439E-03 67218 0.187E-01 0.757E-02
DAV: 3 -0.360163420909E+03 0.40387E-04 -0.99484E-05 71223 0.455E-02 0.400E-02
DAV: 4 -0.360163415459E+03 0.54505E-05 -0.61325E-05 65121 0.276E-02
621 F= -.36016342E+03 E0= -.36016753E+03 d E =-.255373E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360164487512E+03 -0.10666E-02 -0.13618E+00 57720 0.376E+00 0.266E-01
DAV: 2 -0.360165921724E+03 -0.14342E-02 -0.20287E-02 67605 0.435E-01 0.174E-01
DAV: 3 -0.360165699397E+03 0.22233E-03 -0.53217E-04 72321 0.103E-01 0.897E-02
DAV: 4 -0.360165674138E+03 0.25260E-04 -0.30369E-04 67407 0.607E-02 0.200E-02
DAV: 5 -0.360165671336E+03 0.28015E-05 -0.40888E-05 59964 0.265E-02
622 F= -.36016567E+03 E0= -.36016979E+03 d E =-.225588E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360165826451E+03 -0.15231E-03 -0.43662E-01 57720 0.213E+00 0.150E-01
DAV: 2 -0.360166291054E+03 -0.46460E-03 -0.64978E-03 67587 0.246E-01 0.984E-02
DAV: 3 -0.360166221458E+03 0.69595E-04 -0.16923E-04 72384 0.577E-02 0.502E-02
DAV: 4 -0.360166214125E+03 0.73333E-05 -0.93838E-05 67200 0.336E-02
623 F= -.36016621E+03 E0= -.36017034E+03 d E =-.279867E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360167575766E+03 -0.13543E-02 -0.12298E+00 57720 0.358E+00 0.252E-01
DAV: 2 -0.360168913243E+03 -0.13375E-02 -0.18601E-02 68820 0.416E-01 0.166E-01
DAV: 3 -0.360168710260E+03 0.20298E-03 -0.51079E-04 70647 0.100E-01 0.876E-02
DAV: 4 -0.360168684699E+03 0.25561E-04 -0.29162E-04 68298 0.602E-02 0.196E-02
DAV: 5 -0.360168682961E+03 0.17381E-05 -0.44256E-05 59523 0.267E-02
624 F= -.36016868E+03 E0= -.36017281E+03 d E =-.246884E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360168946852E+03 -0.26215E-03 -0.39121E-01 57720 0.202E+00 0.142E-01
DAV: 2 -0.360169376599E+03 -0.42975E-03 -0.59068E-03 68874 0.234E-01 0.931E-02
DAV: 3 -0.360169313958E+03 0.62641E-04 -0.15984E-04 70602 0.556E-02 0.489E-02
DAV: 4 -0.360169306673E+03 0.72856E-05 -0.89906E-05 68244 0.333E-02
625 F= -.36016931E+03 E0= -.36017343E+03 d E =-.309255E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360170419489E+03 -0.11055E-02 -0.12016E+00 57720 0.356E+00 0.254E-01
DAV: 2 -0.360171779478E+03 -0.13600E-02 -0.18868E-02 68793 0.416E-01 0.165E-01
DAV: 3 -0.360171583662E+03 0.19582E-03 -0.47748E-04 70089 0.971E-02 0.866E-02
DAV: 4 -0.360171561581E+03 0.22082E-04 -0.28998E-04 67884 0.601E-02 0.199E-02
DAV: 5 -0.360171558439E+03 0.31414E-05 -0.41920E-05 57048 0.263E-02
626 F= -.36017156E+03 E0= -.36017568E+03 d E =-.225177E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360171691041E+03 -0.12946E-03 -0.17826E-01 57720 0.137E+00 0.976E-02
DAV: 2 -0.360171897823E+03 -0.20678E-03 -0.27996E-03 68730 0.160E-01 0.633E-02
DAV: 3 -0.360171869820E+03 0.28003E-04 -0.69153E-05 69915 0.370E-02 0.331E-02
DAV: 4 -0.360171866952E+03 0.28683E-05 -0.41541E-05 61962 0.228E-02
627 F= -.36017187E+03 E0= -.36017599E+03 d E =-.256028E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360172849511E+03 -0.97969E-03 -0.93504E-01 57720 0.314E+00 0.224E-01
DAV: 2 -0.360173877591E+03 -0.10281E-02 -0.14807E-02 68649 0.369E-01 0.145E-01
DAV: 3 -0.360173729547E+03 0.14804E-03 -0.38637E-04 70719 0.860E-02 0.779E-02
DAV: 4 -0.360173707963E+03 0.21584E-04 -0.23502E-04 66030 0.557E-02 0.180E-02
DAV: 5 -0.360173706506E+03 0.14574E-05 -0.33436E-05 54546 0.231E-02
628 F= -.36017371E+03 E0= -.36017783E+03 d E =-.183955E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360173935127E+03 -0.22716E-03 -0.40099E-01 57720 0.206E+00 0.146E-01
DAV: 2 -0.360174385478E+03 -0.45035E-03 -0.63610E-03 68721 0.241E-01 0.949E-02
DAV: 3 -0.360174323005E+03 0.62473E-04 -0.16085E-04 70692 0.559E-02 0.509E-02
DAV: 4 -0.360174314390E+03 0.86149E-05 -0.99884E-05 66093 0.362E-02
629 F= -.36017431E+03 E0= -.36017844E+03 d E =-.244744E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360175457978E+03 -0.11350E-02 -0.99562E-01 57720 0.324E+00 0.228E-01
DAV: 2 -0.360176537840E+03 -0.10799E-02 -0.15539E-02 67191 0.378E-01 0.150E-01
DAV: 3 -0.360176372023E+03 0.16582E-03 -0.44901E-04 68820 0.895E-02 0.790E-02
DAV: 4 -0.360176346426E+03 0.25597E-04 -0.23585E-04 66975 0.576E-02 0.180E-02
DAV: 5 -0.360176346984E+03 -0.55759E-06 -0.36388E-05 54456 0.229E-02
630 F= -.36017635E+03 E0= -.36018048E+03 d E =-.203259E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360176487118E+03 -0.14069E-03 -0.14654E-01 57720 0.124E+00 0.872E-02
DAV: 2 -0.360176650975E+03 -0.16386E-03 -0.22940E-03 67335 0.145E-01 0.575E-02
DAV: 3 -0.360176627392E+03 0.23583E-04 -0.63172E-05 68424 0.339E-02 0.302E-02
DAV: 4 -0.360176624015E+03 0.33771E-05 -0.33777E-05 60747 0.218E-02
631 F= -.36017662E+03 E0= -.36018075E+03 d E =-.230963E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360177619338E+03 -0.99195E-03 -0.87365E-01 57720 0.304E+00 0.209E-01
DAV: 2 -0.360178556603E+03 -0.93726E-03 -0.13079E-02 68469 0.347E-01 0.138E-01
DAV: 3 -0.360178416510E+03 0.14009E-03 -0.34197E-04 70188 0.792E-02 0.701E-02
DAV: 4 -0.360178400293E+03 0.16217E-04 -0.18226E-04 67857 0.479E-02 0.151E-02
DAV: 5 -0.360178399343E+03 0.95023E-06 -0.24073E-05 46104 0.199E-02
632 F= -.36017840E+03 E0= -.36018253E+03 d E =-.177533E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360178703619E+03 -0.30333E-03 -0.48900E-01 57720 0.227E+00 0.156E-01
DAV: 2 -0.360179233733E+03 -0.53011E-03 -0.73243E-03 68604 0.259E-01 0.103E-01
DAV: 3 -0.360179156095E+03 0.77638E-04 -0.18902E-04 70062 0.588E-02 0.521E-02
DAV: 4 -0.360179147523E+03 0.85718E-05 -0.10006E-04 67776 0.354E-02 0.111E-02
DAV: 5 -0.360179146943E+03 0.58041E-06 -0.12903E-05 39525 0.148E-02
633 F= -.36017915E+03 E0= -.36018328E+03 d E =-.252293E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360177394881E+03 0.17526E-02 -0.19547E+00 57720 0.455E+00 0.312E-01
DAV: 2 -0.360179492421E+03 -0.20975E-02 -0.29256E-02 68487 0.518E-01 0.205E-01
DAV: 3 -0.360179175346E+03 0.31707E-03 -0.76382E-04 70098 0.118E-01 0.104E-01
DAV: 4 -0.360179139354E+03 0.35992E-04 -0.40389E-04 67884 0.711E-02 0.223E-02
DAV: 5 -0.360179137487E+03 0.18671E-05 -0.56227E-05 63087 0.296E-02
634 F= -.36017914E+03 E0= -.36018327E+03 d E =-.251347E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360178912468E+03 0.22689E-03 -0.56953E-01 57720 0.245E+00 0.169E-01
DAV: 2 -0.360179502174E+03 -0.58971E-03 -0.84827E-03 67956 0.279E-01 0.111E-01
DAV: 3 -0.360179405061E+03 0.97113E-04 -0.22822E-04 70242 0.642E-02 0.562E-02
DAV: 4 -0.360179392585E+03 0.12476E-04 -0.11903E-04 67911 0.387E-02 0.122E-02
DAV: 5 -0.360179392154E+03 0.43085E-06 -0.15571E-05 39822 0.158E-02
635 F= -.36017939E+03 E0= -.36018352E+03 d E =-.276814E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360180254942E+03 -0.86236E-03 -0.47066E-01 57720 0.223E+00 0.152E-01
DAV: 2 -0.360180740161E+03 -0.48522E-03 -0.69355E-03 65811 0.252E-01 0.102E-01
DAV: 3 -0.360180661959E+03 0.78202E-04 -0.16700E-04 68712 0.590E-02 0.523E-02
DAV: 4 -0.360180653139E+03 0.88192E-05 -0.11918E-04 68145 0.386E-02 0.115E-02
DAV: 5 -0.360180651663E+03 0.14766E-05 -0.16398E-05 38931 0.177E-02
636 F= -.36018065E+03 E0= -.36018478E+03 d E =-.125951E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360179345382E+03 0.13078E-02 -0.37974E+00 57720 0.634E+00 0.432E-01
DAV: 2 -0.360183349395E+03 -0.40040E-02 -0.56206E-02 66003 0.716E-01 0.289E-01
DAV: 3 -0.360182729941E+03 0.61945E-03 -0.13297E-03 68703 0.167E-01 0.149E-01
DAV: 4 -0.360182664396E+03 0.65545E-04 -0.95934E-04 68118 0.109E-01 0.327E-02
DAV: 5 -0.360182652342E+03 0.12054E-04 -0.14661E-04 66786 0.507E-02 0.151E-02
DAV: 6 -0.360182653068E+03 -0.72619E-06 -0.29444E-05 57786 0.176E-02
637 F= -.36018265E+03 E0= -.36018679E+03 d E =-.326091E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360182359556E+03 0.29279E-03 -0.50732E-01 57720 0.232E+00 0.159E-01
DAV: 2 -0.360182895255E+03 -0.53570E-03 -0.75197E-03 66372 0.262E-01 0.106E-01
DAV: 3 -0.360182813277E+03 0.81978E-04 -0.17883E-04 68703 0.613E-02 0.544E-02
DAV: 4 -0.360182805016E+03 0.82611E-05 -0.12512E-04 68127 0.394E-02 0.118E-02
DAV: 5 -0.360182803449E+03 0.15677E-05 -0.17073E-05 40524 0.180E-02
638 F= -.36018280E+03 E0= -.36018694E+03 d E =-.341129E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360183828706E+03 -0.10237E-02 -0.12634E+00 57720 0.367E+00 0.251E-01
DAV: 2 -0.360185220558E+03 -0.13919E-02 -0.19705E-02 66672 0.424E-01 0.166E-01
DAV: 3 -0.360185017188E+03 0.20337E-03 -0.47932E-04 69153 0.932E-02 0.880E-02
DAV: 4 -0.360184991020E+03 0.26167E-04 -0.31731E-04 67821 0.642E-02 0.197E-02
DAV: 5 -0.360184988182E+03 0.28383E-05 -0.53213E-05 60801 0.293E-02
639 F= -.36018499E+03 E0= -.36018912E+03 d E =-.218473E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360184998342E+03 -0.73211E-05 -0.17296E+00 57720 0.429E+00 0.294E-01
DAV: 2 -0.360186913152E+03 -0.19148E-02 -0.27020E-02 66819 0.496E-01 0.194E-01
DAV: 3 -0.360186636114E+03 0.27704E-03 -0.65561E-04 69117 0.109E-01 0.103E-01
DAV: 4 -0.360186600893E+03 0.35221E-04 -0.43348E-04 67884 0.751E-02 0.230E-02
DAV: 5 -0.360186597026E+03 0.38669E-05 -0.73512E-05 65409 0.342E-02
640 F= -.36018660E+03 E0= -.36019073E+03 d E =-.379358E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360180364265E+03 0.62366E-02 -0.69180E+00 57720 0.858E+00 0.587E-01
DAV: 2 -0.360188013797E+03 -0.76495E-02 -0.10838E-01 66669 0.995E-01 0.389E-01
DAV: 3 -0.360186892738E+03 0.11211E-02 -0.26509E-03 69072 0.218E-01 0.207E-01
DAV: 4 -0.360186746024E+03 0.14671E-03 -0.17549E-03 67812 0.151E-01 0.462E-02
DAV: 5 -0.360186730554E+03 0.15470E-04 -0.29841E-04 67722 0.687E-02 0.204E-02
DAV: 6 -0.360186731751E+03 -0.11966E-05 -0.55938E-05 64113 0.236E-02
641 F= -.36018673E+03 E0= -.36019087E+03 d E =-.392830E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360185730436E+03 0.10001E-02 -0.16132E+00 57720 0.414E+00 0.283E-01
DAV: 2 -0.360187484288E+03 -0.17539E-02 -0.25132E-02 66426 0.479E-01 0.186E-01
DAV: 3 -0.360187218914E+03 0.26537E-03 -0.61038E-04 69342 0.105E-01 0.998E-02
DAV: 4 -0.360187181811E+03 0.37103E-04 -0.40903E-04 68001 0.729E-02 0.224E-02
DAV: 5 -0.360187178742E+03 0.30689E-05 -0.69237E-05 64515 0.332E-02
642 F= -.36018718E+03 E0= -.36019132E+03 d E =-.437529E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360187747166E+03 -0.56535E-03 -0.23989E+00 57720 0.507E+00 0.348E-01
DAV: 2 -0.360190477273E+03 -0.27301E-02 -0.38465E-02 66603 0.591E-01 0.230E-01
DAV: 3 -0.360190095898E+03 0.38137E-03 -0.94489E-04 68802 0.134E-01 0.124E-01
DAV: 4 -0.360190036471E+03 0.59427E-04 -0.60685E-04 68460 0.906E-02 0.278E-02
DAV: 5 -0.360190033019E+03 0.34525E-05 -0.10253E-04 66660 0.406E-02 0.126E-02
DAV: 6 -0.360190032996E+03 0.22277E-07 -0.17016E-05 44223 0.141E-02
643 F= -.36019003E+03 E0= -.36019418E+03 d E =-.285425E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360188367344E+03 0.16657E-02 -0.28844E+00 57720 0.556E+00 0.383E-01
DAV: 2 -0.360191699857E+03 -0.33325E-02 -0.46395E-02 66855 0.649E-01 0.254E-01
DAV: 3 -0.360191249642E+03 0.45021E-03 -0.11238E-03 68775 0.147E-01 0.136E-01
DAV: 4 -0.360191182921E+03 0.66721E-04 -0.72454E-04 68406 0.989E-02 0.304E-02
DAV: 5 -0.360191178385E+03 0.45368E-05 -0.12252E-04 68487 0.444E-02 0.138E-02
DAV: 6 -0.360191178392E+03 -0.74215E-08 -0.20143E-05 45717 0.154E-02
644 F= -.36019118E+03 E0= -.36019533E+03 d E =-.399965E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360190968915E+03 0.20947E-03 -0.34824E+00 57720 0.612E+00 0.421E-01
DAV: 2 -0.360195171091E+03 -0.42022E-02 -0.57136E-02 66636 0.718E-01 0.271E-01
DAV: 3 -0.360194658913E+03 0.51218E-03 -0.13624E-03 69630 0.154E-01 0.143E-01
DAV: 4 -0.360194586670E+03 0.72243E-04 -0.74579E-04 68415 0.102E-01 0.299E-02
DAV: 5 -0.360194585775E+03 0.89491E-06 -0.12811E-04 66075 0.425E-02 0.143E-02
DAV: 6 -0.360194585152E+03 0.62276E-06 -0.18295E-05 45402 0.149E-02
645 F= -.36019459E+03 E0= -.36019874E+03 d E =-.340676E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360190994842E+03 0.35909E-02 -0.48155E+00 57720 0.719E+00 0.496E-01
DAV: 2 -0.360196812940E+03 -0.58181E-02 -0.79119E-02 66624 0.845E-01 0.319E-01
DAV: 3 -0.360196102103E+03 0.71084E-03 -0.18814E-03 69630 0.181E-01 0.169E-01
DAV: 4 -0.360196001585E+03 0.10052E-03 -0.10373E-03 68397 0.121E-01 0.352E-02
DAV: 5 -0.360196000107E+03 0.14784E-05 -0.17795E-04 66102 0.500E-02 0.168E-02
DAV: 6 -0.360195999280E+03 0.82672E-06 -0.26218E-05 50856 0.176E-02
646 F= -.36019600E+03 E0= -.36020016E+03 d E =-.482089E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360195053683E+03 0.94642E-03 -0.45875E+00 57720 0.700E+00 0.480E-01
DAV: 2 -0.360200334683E+03 -0.52810E-02 -0.73449E-02 66267 0.819E-01 0.312E-01
DAV: 3 -0.360199642857E+03 0.69183E-03 -0.17398E-03 69540 0.183E-01 0.170E-01
DAV: 4 -0.360199544648E+03 0.98208E-04 -0.11810E-03 66786 0.126E-01 0.375E-02
DAV: 5 -0.360199536846E+03 0.78023E-05 -0.18800E-04 66858 0.550E-02 0.174E-02
DAV: 6 -0.360199537036E+03 -0.19009E-06 -0.40200E-05 62016 0.205E-02
647 F= -.36019954E+03 E0= -.36020370E+03 d E =-.353776E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360195880048E+03 0.36568E-02 -0.49986E+00 57720 0.730E+00 0.501E-01
DAV: 2 -0.360201636133E+03 -0.57561E-02 -0.80100E-02 66393 0.855E-01 0.326E-01
DAV: 3 -0.360200883657E+03 0.75248E-03 -0.19015E-03 69540 0.192E-01 0.177E-01
DAV: 4 -0.360200776976E+03 0.10668E-03 -0.12825E-03 66840 0.132E-01 0.391E-02
DAV: 5 -0.360200768636E+03 0.83400E-05 -0.20384E-04 66957 0.573E-02 0.182E-02
DAV: 6 -0.360200768838E+03 -0.20139E-06 -0.43719E-05 62781 0.214E-02
648 F= -.36020077E+03 E0= -.36020493E+03 d E =-.476956E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360198316938E+03 0.24517E-02 -0.63086E+00 57720 0.822E+00 0.560E-01
DAV: 2 -0.360205726623E+03 -0.74097E-02 -0.10127E-01 66744 0.959E-01 0.366E-01
DAV: 3 -0.360204729088E+03 0.99754E-03 -0.22035E-03 69756 0.215E-01 0.201E-01
DAV: 4 -0.360204600140E+03 0.12895E-03 -0.18517E-03 66381 0.157E-01 0.463E-02
DAV: 5 -0.360204575271E+03 0.24869E-04 -0.30304E-04 66453 0.719E-02 0.214E-02
DAV: 6 -0.360204577115E+03 -0.18438E-05 -0.74481E-05 64725 0.269E-02
649 F= -.36020458E+03 E0= -.36020875E+03 d E =-.380828E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360202314070E+03 0.22612E-02 -0.30912E+00 57720 0.575E+00 0.393E-01
DAV: 2 -0.360205938741E+03 -0.36247E-02 -0.49553E-02 66930 0.671E-01 0.257E-01
DAV: 3 -0.360205452987E+03 0.48575E-03 -0.10803E-03 69747 0.150E-01 0.140E-01
DAV: 4 -0.360205391362E+03 0.61625E-04 -0.89483E-04 66435 0.109E-01 0.320E-02
DAV: 5 -0.360205379786E+03 0.11577E-04 -0.14539E-04 66534 0.497E-02 0.149E-02
DAV: 6 -0.360205380572E+03 -0.78627E-06 -0.35247E-05 60783 0.187E-02
650 F= -.36020538E+03 E0= -.36020955E+03 d E =-.461173E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360201609464E+03 0.37703E-02 -0.74293E+00 57720 0.894E+00 0.612E-01
DAV: 2 -0.360210508523E+03 -0.88991E-02 -0.12173E-01 66351 0.105E+00 0.397E-01
DAV: 3 -0.360209352397E+03 0.11561E-02 -0.26872E-03 70332 0.233E-01 0.216E-01
DAV: 4 -0.360209199226E+03 0.15317E-03 -0.20485E-03 66516 0.165E-01 0.487E-02
DAV: 5 -0.360209175412E+03 0.23814E-04 -0.32356E-04 66687 0.744E-02 0.224E-02
DAV: 6 -0.360209177408E+03 -0.19958E-05 -0.76345E-05 64707 0.274E-02
651 F= -.36020918E+03 E0= -.36021336E+03 d E =-.379684E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360208573860E+03 0.60155E-03 -0.84519E-01 57720 0.301E+00 0.208E-01
DAV: 2 -0.360209587699E+03 -0.10138E-02 -0.13832E-02 66759 0.354E-01 0.135E-01
DAV: 3 -0.360209459350E+03 0.12835E-03 -0.30709E-04 70278 0.784E-02 0.728E-02
DAV: 4 -0.360209443235E+03 0.16115E-04 -0.22320E-04 66822 0.544E-02 0.160E-02
DAV: 5 -0.360209440817E+03 0.24173E-05 -0.33454E-05 55617 0.242E-02
652 F= -.36020944E+03 E0= -.36021362E+03 d E =-.406025E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360205500659E+03 0.39426E-02 -0.67403E+00 57720 0.854E+00 0.582E-01
DAV: 2 -0.360213865282E+03 -0.83646E-02 -0.11336E-01 65643 0.101E+00 0.379E-01
DAV: 3 -0.360212872891E+03 0.99239E-03 -0.26467E-03 68910 0.223E-01 0.208E-01
DAV: 4 -0.360212730170E+03 0.14272E-03 -0.18121E-03 66975 0.160E-01 0.481E-02
DAV: 5 -0.360212716033E+03 0.14137E-04 -0.30939E-04 66381 0.722E-02 0.223E-02
DAV: 6 -0.360212716257E+03 -0.22465E-06 -0.63333E-05 64761 0.263E-02
653 F= -.36021272E+03 E0= -.36021690E+03 d E =-.327544E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360212545628E+03 0.17040E-03 -0.25779E-01 57726 0.167E+00 0.116E-01
DAV: 2 -0.360212868910E+03 -0.32328E-03 -0.43479E-03 66417 0.198E-01 0.750E-02
DAV: 3 -0.360212832368E+03 0.36542E-04 -0.10318E-04 68910 0.439E-02 0.407E-02
DAV: 4 -0.360212827662E+03 0.47055E-05 -0.64422E-05 66183 0.302E-02
654 F= -.36021283E+03 E0= -.36021701E+03 d E =-.338685E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360208352864E+03 0.44795E-02 -0.63139E+00 57720 0.830E+00 0.571E-01
DAV: 2 -0.360216686411E+03 -0.83335E-02 -0.11179E-01 67182 0.100E+00 0.362E-01
DAV: 3 -0.360215773093E+03 0.91332E-03 -0.26352E-03 70413 0.210E-01 0.202E-01
DAV: 4 -0.360215629075E+03 0.14402E-03 -0.16049E-03 66246 0.153E-01 0.460E-02
DAV: 5 -0.360215623747E+03 0.53278E-05 -0.28604E-04 66192 0.645E-02 0.218E-02
DAV: 6 -0.360215623487E+03 0.26022E-06 -0.58886E-05 64194 0.248E-02
655 F= -.36021562E+03 E0= -.36021981E+03 d E =-.279582E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360215622092E+03 0.16544E-05 -0.37157E-05 58839 0.222E-02 0.537E-03
DAV: 2 -0.360215622367E+03 -0.27481E-06 -0.26348E-06 34395 0.543E-03
656 F= -.36021562E+03 E0= -.36021981E+03 d E =-.279470E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360214213845E+03 0.14082E-02 -0.29430E+00 57720 0.567E+00 0.386E-01
DAV: 2 -0.360218109801E+03 -0.38960E-02 -0.51679E-02 64905 0.680E-01 0.249E-01
DAV: 3 -0.360217695768E+03 0.41403E-03 -0.11636E-03 70008 0.148E-01 0.138E-01
DAV: 4 -0.360217631377E+03 0.64391E-04 -0.78031E-04 65805 0.106E-01 0.319E-02
DAV: 5 -0.360217626766E+03 0.46110E-05 -0.13024E-04 66030 0.458E-02 0.153E-02
DAV: 6 -0.360217626700E+03 0.66009E-07 -0.29264E-05 55500 0.179E-02
657 F= -.36021763E+03 E0= -.36022182E+03 d E =-.200433E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360217538483E+03 0.88283E-04 -0.12452E-01 57738 0.117E+00 0.806E-02
DAV: 2 -0.360217705955E+03 -0.16747E-03 -0.21934E-03 65184 0.140E-01 0.517E-02
DAV: 3 -0.360217689493E+03 0.16463E-04 -0.50398E-05 69849 0.308E-02 0.284E-02
DAV: 4 -0.360217687151E+03 0.23419E-05 -0.29100E-05 51684 0.210E-02
658 F= -.36021769E+03 E0= -.36022188E+03 d E =-.206478E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360216524743E+03 0.11647E-02 -0.30050E+00 57720 0.572E+00 0.382E-01
DAV: 2 -0.360220519313E+03 -0.39946E-02 -0.51936E-02 65823 0.682E-01 0.243E-01
DAV: 3 -0.360220103744E+03 0.41557E-03 -0.11066E-03 70458 0.144E-01 0.135E-01
DAV: 4 -0.360220044240E+03 0.59505E-04 -0.76709E-04 66192 0.104E-01 0.307E-02
DAV: 5 -0.360220039019E+03 0.52203E-05 -0.12516E-04 67227 0.451E-02 0.146E-02
DAV: 6 -0.360220039271E+03 -0.25194E-06 -0.26276E-05 52836 0.165E-02
659 F= -.36022004E+03 E0= -.36022423E+03 d E =-.235212E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360219605261E+03 0.43376E-03 -0.74616E-01 57720 0.285E+00 0.191E-01
DAV: 2 -0.360220598069E+03 -0.99281E-03 -0.12877E-02 66030 0.339E-01 0.121E-01
DAV: 3 -0.360220496127E+03 0.10194E-03 -0.27508E-04 70431 0.714E-02 0.670E-02
DAV: 4 -0.360220482087E+03 0.14040E-04 -0.18379E-04 66237 0.508E-02 0.150E-02
DAV: 5 -0.360220480930E+03 0.11572E-05 -0.28401E-05 51198 0.218E-02
660 F= -.36022048E+03 E0= -.36022467E+03 d E =-.279378E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360219778707E+03 0.70338E-03 -0.21057E+00 57720 0.480E+00 0.322E-01
DAV: 2 -0.360222604792E+03 -0.28261E-02 -0.37807E-02 65679 0.587E-01 0.210E-01
DAV: 3 -0.360222280906E+03 0.32389E-03 -0.86351E-04 69819 0.130E-01 0.121E-01
DAV: 4 -0.360222225899E+03 0.55008E-04 -0.72364E-04 66237 0.102E-01 0.307E-02
DAV: 5 -0.360222218473E+03 0.74260E-05 -0.12073E-04 68352 0.462E-02 0.144E-02
DAV: 6 -0.360222219040E+03 -0.56713E-06 -0.28985E-05 55617 0.171E-02
661 F= -.36022222E+03 E0= -.36022641E+03 d E =-.173811E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360222218519E+03 -0.46048E-07 -0.17893E-05 38733 0.152E-02 0.355E-03
DAV: 2 -0.360222218676E+03 -0.15676E-06 -0.16861E-06 31326 0.443E-03
662 F= -.36022222E+03 E0= -.36022641E+03 d E =-.173775E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360222012633E+03 0.20589E-03 -0.14632E+00 57720 0.400E+00 0.270E-01
DAV: 2 -0.360224025196E+03 -0.20126E-02 -0.26697E-02 66165 0.488E-01 0.171E-01
DAV: 3 -0.360223813881E+03 0.21131E-03 -0.57491E-04 71196 0.103E-01 0.983E-02
DAV: 4 -0.360223782661E+03 0.31221E-04 -0.45045E-04 66012 0.806E-02 0.247E-02
DAV: 5 -0.360223777609E+03 0.50518E-05 -0.75096E-05 65544 0.355E-02
663 F= -.36022378E+03 E0= -.36022797E+03 d E =-.155893E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360223608446E+03 0.17422E-03 -0.36069E-01 57720 0.198E+00 0.135E-01
DAV: 2 -0.360224121733E+03 -0.51329E-03 -0.66285E-03 66417 0.243E-01 0.850E-02
DAV: 3 -0.360224071946E+03 0.49787E-04 -0.13662E-04 71205 0.513E-02 0.491E-02
DAV: 4 -0.360224065591E+03 0.63553E-05 -0.11142E-04 65994 0.400E-02 0.125E-02
DAV: 5 -0.360224063969E+03 0.16218E-05 -0.17544E-05 46509 0.180E-02
664 F= -.36022406E+03 E0= -.36022826E+03 d E =-.184529E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360224270060E+03 -0.20447E-03 -0.13886E+00 57720 0.390E+00 0.264E-01
DAV: 2 -0.360226309450E+03 -0.20394E-02 -0.26365E-02 66831 0.478E-01 0.166E-01
DAV: 3 -0.360226117939E+03 0.19151E-03 -0.53031E-04 71205 0.100E-01 0.951E-02
DAV: 4 -0.360226090212E+03 0.27727E-04 -0.38833E-04 66111 0.755E-02 0.228E-02
DAV: 5 -0.360226088425E+03 0.17874E-05 -0.64733E-05 64032 0.314E-02
665 F= -.36022609E+03 E0= -.36023029E+03 d E =-.202446E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360225990463E+03 0.99749E-04 -0.32275E-01 57720 0.188E+00 0.128E-01
DAV: 2 -0.360226475569E+03 -0.48511E-03 -0.61639E-03 66993 0.231E-01 0.799E-02
DAV: 3 -0.360226432998E+03 0.42570E-04 -0.11973E-04 71115 0.483E-02 0.462E-02
DAV: 4 -0.360226427669E+03 0.53294E-05 -0.91622E-05 66084 0.367E-02
666 F= -.36022643E+03 E0= -.36023063E+03 d E =-.236370E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360226059689E+03 0.37331E-03 -0.16419E+00 57720 0.423E+00 0.289E-01
DAV: 2 -0.360228473734E+03 -0.24140E-02 -0.31750E-02 67911 0.524E-01 0.182E-01
DAV: 3 -0.360228246917E+03 0.22682E-03 -0.77738E-04 70890 0.116E-01 0.105E-01
DAV: 4 -0.360228206618E+03 0.40299E-04 -0.41446E-04 66273 0.793E-02 0.280E-02
DAV: 5 -0.360228208618E+03 -0.20005E-05 -0.71643E-05 64635 0.312E-02
667 F= -.36022821E+03 E0= -.36023241E+03 d E =-.178095E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360228206184E+03 0.43377E-06 -0.66335E-02 57738 0.851E-01 0.586E-02
DAV: 2 -0.360228310473E+03 -0.10429E-03 -0.13013E-03 68190 0.106E-01 0.365E-02
DAV: 3 -0.360228302224E+03 0.82491E-05 -0.26526E-05 55761 0.229E-02
668 F= -.36022830E+03 E0= -.36023250E+03 d E =-.187455E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360228227185E+03 0.83287E-04 -0.13654E+00 57720 0.386E+00 0.266E-01
DAV: 2 -0.360230163520E+03 -0.19363E-02 -0.26224E-02 68397 0.479E-01 0.164E-01
DAV: 3 -0.360229982114E+03 0.18141E-03 -0.62719E-04 71493 0.984E-02 0.928E-02
DAV: 4 -0.360229952100E+03 0.30015E-04 -0.33645E-04 66264 0.716E-02 0.229E-02
DAV: 5 -0.360229952860E+03 -0.76056E-06 -0.58279E-05 62331 0.284E-02
669 F= -.36022995E+03 E0= -.36023415E+03 d E =-.165064E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360229717929E+03 0.23417E-03 -0.36332E-01 57720 0.199E+00 0.136E-01
DAV: 2 -0.360230258025E+03 -0.54010E-03 -0.70733E-03 68424 0.248E-01 0.837E-02
DAV: 3 -0.360230211166E+03 0.46859E-04 -0.15419E-04 71466 0.501E-02 0.481E-02
DAV: 4 -0.360230203892E+03 0.72731E-05 -0.92567E-05 66255 0.373E-02
670 F= -.36023020E+03 E0= -.36023440E+03 d E =-.190167E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360230418134E+03 -0.20697E-03 -0.89329E-01 57720 0.313E+00 0.214E-01
DAV: 2 -0.360231712455E+03 -0.12943E-02 -0.17042E-02 66921 0.387E-01 0.137E-01
DAV: 3 -0.360231586332E+03 0.12612E-03 -0.36841E-04 71745 0.846E-02 0.812E-02
DAV: 4 -0.360231566094E+03 0.20238E-04 -0.30264E-04 66021 0.666E-02 0.208E-02
DAV: 5 -0.360231563518E+03 0.25760E-05 -0.47909E-05 60126 0.283E-02
671 F= -.36023156E+03 E0= -.36023576E+03 d E =-.135963E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360231640371E+03 -0.74277E-04 -0.19160E-01 57726 0.145E+00 0.985E-02
DAV: 2 -0.360231926411E+03 -0.28604E-03 -0.36740E-03 67074 0.179E-01 0.635E-02
DAV: 3 -0.360231900053E+03 0.26358E-04 -0.75748E-05 71457 0.389E-02 0.376E-02
DAV: 4 -0.360231896242E+03 0.38111E-05 -0.65722E-05 65994 0.309E-02
672 F= -.36023190E+03 E0= -.36023610E+03 d E =-.169235E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360231008982E+03 0.89107E-03 -0.76657E-01 57720 0.290E+00 0.198E-01
DAV: 2 -0.360232120756E+03 -0.11118E-02 -0.14648E-02 66966 0.359E-01 0.127E-01
DAV: 3 -0.360232011984E+03 0.10877E-03 -0.31730E-04 71736 0.784E-02 0.753E-02
DAV: 4 -0.360231994084E+03 0.17900E-04 -0.26031E-04 66021 0.617E-02 0.193E-02
DAV: 5 -0.360231991903E+03 0.21815E-05 -0.40893E-05 58191 0.262E-02
673 F= -.36023199E+03 E0= -.36023619E+03 d E =-.178801E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360231799452E+03 0.19463E-03 -0.20092E-01 57720 0.148E+00 0.100E-01
DAV: 2 -0.360232073462E+03 -0.27401E-03 -0.37248E-03 66309 0.181E-01 0.647E-02
DAV: 3 -0.360232043324E+03 0.30138E-04 -0.85282E-05 71652 0.397E-02 0.374E-02
DAV: 4 -0.360232037664E+03 0.56600E-05 -0.61607E-05 66048 0.300E-02
674 F= -.36023204E+03 E0= -.36023624E+03 d E =-.183377E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360232041222E+03 0.21021E-05 -0.11894E+00 57720 0.362E+00 0.238E-01
DAV: 2 -0.360233781097E+03 -0.17399E-02 -0.22419E-02 67299 0.444E-01 0.152E-01
DAV: 3 -0.360233603783E+03 0.17731E-03 -0.45382E-04 72906 0.910E-02 0.879E-02
DAV: 4 -0.360233575535E+03 0.28248E-04 -0.36309E-04 66228 0.734E-02 0.214E-02
DAV: 5 -0.360233572927E+03 0.26086E-05 -0.63600E-05 62547 0.314E-02
675 F= -.36023357E+03 E0= -.36023778E+03 d E =-.153526E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360231839401E+03 0.17361E-02 -0.14535E+00 57720 0.400E+00 0.265E-01
DAV: 2 -0.360234018779E+03 -0.21794E-02 -0.27670E-02 67524 0.493E-01 0.169E-01
DAV: 3 -0.360233809601E+03 0.20918E-03 -0.54611E-04 72834 0.101E-01 0.985E-02
DAV: 4 -0.360233779297E+03 0.30305E-04 -0.45825E-04 66210 0.825E-02 0.245E-02
DAV: 5 -0.360233775077E+03 0.42197E-05 -0.81485E-05 65238 0.358E-02
676 F= -.36023378E+03 E0= -.36023798E+03 d E =-.173741E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360233580527E+03 0.19877E-03 -0.24893E-01 57720 0.165E+00 0.109E-01
DAV: 2 -0.360233926346E+03 -0.34582E-03 -0.46181E-03 67128 0.202E-01 0.697E-02
DAV: 3 -0.360233887967E+03 0.38379E-04 -0.10054E-04 71853 0.419E-02 0.399E-02
DAV: 4 -0.360233881404E+03 0.65635E-05 -0.74033E-05 66273 0.332E-02
677 F= -.36023388E+03 E0= -.36023809E+03 d E =-.184374E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360233827342E+03 0.60626E-04 -0.13460E+00 57720 0.384E+00 0.252E-01
DAV: 2 -0.360235732055E+03 -0.19047E-02 -0.24780E-02 66201 0.467E-01 0.162E-01
DAV: 3 -0.360235536138E+03 0.19592E-03 -0.50979E-04 72726 0.100E-01 0.931E-02
DAV: 4 -0.360235506709E+03 0.29429E-04 -0.39669E-04 66273 0.759E-02 0.228E-02
DAV: 5 -0.360235504942E+03 0.17664E-05 -0.63617E-05 62808 0.314E-02
678 F= -.36023550E+03 E0= -.36023971E+03 d E =-.162354E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360235016717E+03 0.48999E-03 -0.79327E-01 57720 0.295E+00 0.195E-01
DAV: 2 -0.360236174603E+03 -0.11579E-02 -0.14775E-02 66831 0.360E-01 0.125E-01
DAV: 3 -0.360236064230E+03 0.11037E-03 -0.29425E-04 72645 0.774E-02 0.728E-02
DAV: 4 -0.360236049881E+03 0.14349E-04 -0.24311E-04 66237 0.594E-02 0.182E-02
DAV: 5 -0.360236048127E+03 0.17537E-05 -0.38239E-05 56391 0.249E-02
679 F= -.36023605E+03 E0= -.36024026E+03 d E =-.216672E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360236041292E+03 0.85890E-05 -0.11947E+00 57720 0.363E+00 0.247E-01
DAV: 2 -0.360237855617E+03 -0.18143E-02 -0.23837E-02 67758 0.459E-01 0.156E-01
DAV: 3 -0.360237687694E+03 0.16792E-03 -0.54768E-04 71097 0.100E-01 0.918E-02
DAV: 4 -0.360237660993E+03 0.26702E-04 -0.36401E-04 66246 0.726E-02 0.243E-02
DAV: 5 -0.360237660062E+03 0.93129E-06 -0.58279E-05 63195 0.301E-02
680 F= -.36023766E+03 E0= -.36024187E+03 d E =-.161193E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360237638431E+03 0.22562E-04 -0.97210E-02 57726 0.103E+00 0.712E-02
DAV: 2 -0.360237792730E+03 -0.15430E-03 -0.19613E-03 67857 0.131E-01 0.448E-02
DAV: 3 -0.360237780130E+03 0.12600E-04 -0.41338E-05 64464 0.284E-02 0.265E-02
DAV: 4 -0.360237778809E+03 0.13206E-05 -0.31645E-05 56175 0.214E-02
681 F= -.36023778E+03 E0= -.36024199E+03 d E =-.173068E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360237889061E+03 -0.10893E-03 -0.10316E+00 57720 0.337E+00 0.231E-01
DAV: 2 -0.360239453927E+03 -0.15649E-02 -0.20583E-02 67668 0.426E-01 0.142E-01
DAV: 3 -0.360239317907E+03 0.13602E-03 -0.46585E-04 71943 0.889E-02 0.831E-02
DAV: 4 -0.360239298655E+03 0.19252E-04 -0.28375E-04 66264 0.663E-02 0.216E-02
DAV: 5 -0.360239298790E+03 -0.13497E-06 -0.50014E-05 61404 0.272E-02
682 F= -.36023930E+03 E0= -.36024351E+03 d E =-.151998E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360239175354E+03 0.12330E-03 -0.48351E-01 57720 0.231E+00 0.158E-01
DAV: 2 -0.360239922421E+03 -0.74707E-03 -0.96624E-03 67695 0.292E-01 0.972E-02
DAV: 3 -0.360239860652E+03 0.61770E-04 -0.20972E-04 71916 0.602E-02 0.569E-02
DAV: 4 -0.360239852992E+03 0.76602E-05 -0.13305E-04 66246 0.453E-02 0.146E-02
DAV: 5 -0.360239852817E+03 0.17414E-06 -0.22657E-05 49605 0.188E-02
683 F= -.36023985E+03 E0= -.36024406E+03 d E =-.207401E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360237101762E+03 0.27512E-02 -0.19325E+00 57720 0.462E+00 0.315E-01
DAV: 2 -0.360240053092E+03 -0.29513E-02 -0.38615E-02 67668 0.583E-01 0.194E-01
DAV: 3 -0.360239797213E+03 0.25588E-03 -0.85856E-04 71952 0.121E-01 0.114E-01
DAV: 4 -0.360239760914E+03 0.36298E-04 -0.53376E-04 66255 0.908E-02 0.293E-02
DAV: 5 -0.360239760825E+03 0.89631E-07 -0.94988E-05 65553 0.373E-02
684 F= -.36023976E+03 E0= -.36024397E+03 d E =-.198202E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360239117470E+03 0.64344E-03 -0.69439E-01 57720 0.277E+00 0.187E-01
DAV: 2 -0.360240122232E+03 -0.10048E-02 -0.13528E-02 67434 0.347E-01 0.116E-01
DAV: 3 -0.360240025395E+03 0.96837E-04 -0.32485E-04 72024 0.728E-02 0.667E-02
DAV: 4 -0.360240008418E+03 0.16978E-04 -0.17541E-04 66282 0.522E-02 0.171E-02
DAV: 5 -0.360240008856E+03 -0.43788E-06 -0.30377E-05 51234 0.210E-02
685 F= -.36024001E+03 E0= -.36024422E+03 d E =-.223005E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360240096316E+03 -0.87898E-04 -0.10339E+00 57720 0.337E+00 0.226E-01
DAV: 2 -0.360241615384E+03 -0.15191E-02 -0.20121E-02 67416 0.421E-01 0.143E-01
DAV: 3 -0.360241464464E+03 0.15092E-03 -0.44757E-04 71673 0.904E-02 0.840E-02
DAV: 4 -0.360241439523E+03 0.24941E-04 -0.31340E-04 66291 0.687E-02 0.215E-02
DAV: 5 -0.360241439371E+03 0.15199E-06 -0.53295E-05 61539 0.284E-02
686 F= -.36024144E+03 E0= -.36024565E+03 d E =-.143052E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360240745191E+03 0.69433E-03 -0.88945E-01 57720 0.313E+00 0.211E-01
DAV: 2 -0.360242097572E+03 -0.13524E-02 -0.17479E-02 67542 0.392E-01 0.133E-01
DAV: 3 -0.360241973367E+03 0.12420E-03 -0.36983E-04 71547 0.837E-02 0.788E-02
DAV: 4 -0.360241955896E+03 0.17471E-04 -0.27863E-04 66282 0.647E-02 0.203E-02
DAV: 5 -0.360241954930E+03 0.96644E-06 -0.46745E-05 59496 0.272E-02
687 F= -.36024195E+03 E0= -.36024617E+03 d E =-.194607E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360242445602E+03 -0.48971E-03 -0.66718E-01 57720 0.272E+00 0.181E-01
DAV: 2 -0.360243449959E+03 -0.10044E-02 -0.12874E-02 68028 0.339E-01 0.114E-01
DAV: 3 -0.360243356436E+03 0.93523E-04 -0.27271E-04 72870 0.740E-02 0.663E-02
DAV: 4 -0.360243346819E+03 0.96172E-05 -0.20867E-04 66183 0.541E-02 0.178E-02
DAV: 5 -0.360243344483E+03 0.23365E-05 -0.31073E-05 53952 0.236E-02
688 F= -.36024334E+03 E0= -.36024756E+03 d E =-.138955E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360243345419E+03 0.14002E-05 -0.50013E-01 57720 0.236E+00 0.156E-01
DAV: 2 -0.360244098246E+03 -0.75283E-03 -0.96374E-03 68019 0.293E-01 0.989E-02
DAV: 3 -0.360244027728E+03 0.70518E-04 -0.20327E-04 72888 0.641E-02 0.573E-02
DAV: 4 -0.360244020517E+03 0.72105E-05 -0.15559E-04 66174 0.466E-02 0.154E-02
DAV: 5 -0.360244018757E+03 0.17598E-05 -0.22832E-05 49974 0.203E-02
689 F= -.36024402E+03 E0= -.36024824E+03 d E =-.206383E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360241232612E+03 0.27879E-02 -0.19990E+00 57720 0.472E+00 0.313E-01
DAV: 2 -0.360244216496E+03 -0.29839E-02 -0.38530E-02 68010 0.586E-01 0.198E-01
DAV: 3 -0.360243930498E+03 0.28600E-03 -0.82309E-04 72888 0.128E-01 0.114E-01
DAV: 4 -0.360243898592E+03 0.31906E-04 -0.62543E-04 66210 0.938E-02 0.307E-02
DAV: 5 -0.360243892336E+03 0.62567E-05 -0.97082E-05 68514 0.406E-02
690 F= -.36024389E+03 E0= -.36024811E+03 d E =-.193741E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360243294172E+03 0.60442E-03 -0.72999E-01 57720 0.285E+00 0.187E-01
DAV: 2 -0.360244327648E+03 -0.10335E-02 -0.13769E-02 67893 0.352E-01 0.119E-01
DAV: 3 -0.360244219869E+03 0.10778E-03 -0.31058E-04 72996 0.768E-02 0.678E-02
DAV: 4 -0.360244205198E+03 0.14670E-04 -0.21261E-04 66246 0.547E-02 0.177E-02
DAV: 5 -0.360244203725E+03 0.14729E-05 -0.31156E-05 53439 0.232E-02
691 F= -.36024420E+03 E0= -.36024842E+03 d E =-.224880E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360244585962E+03 -0.38076E-03 -0.63125E-01 57720 0.265E+00 0.176E-01
DAV: 2 -0.360245508165E+03 -0.92220E-03 -0.12117E-02 67290 0.329E-01 0.110E-01
DAV: 3 -0.360245418843E+03 0.89322E-04 -0.26652E-04 72339 0.706E-02 0.636E-02
DAV: 4 -0.360245405867E+03 0.12976E-04 -0.18800E-04 66273 0.527E-02 0.163E-02
DAV: 5 -0.360245404983E+03 0.88403E-06 -0.29571E-05 51378 0.221E-02
692 F= -.36024540E+03 E0= -.36024963E+03 d E =-.120126E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360244548597E+03 0.85727E-03 -0.11953E+00 57720 0.364E+00 0.243E-01
DAV: 2 -0.360246355761E+03 -0.18072E-02 -0.23195E-02 67416 0.454E-01 0.152E-01
DAV: 3 -0.360246191939E+03 0.16382E-03 -0.48798E-04 72366 0.974E-02 0.886E-02
DAV: 4 -0.360246171880E+03 0.20059E-04 -0.36766E-04 66255 0.735E-02 0.229E-02
DAV: 5 -0.360246169388E+03 0.24920E-05 -0.60014E-05 62511 0.313E-02
693 F= -.36024617E+03 E0= -.36025039E+03 d E =-.196566E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360246553343E+03 -0.38146E-03 -0.63028E-01 57720 0.264E+00 0.180E-01
DAV: 2 -0.360247563890E+03 -0.10105E-02 -0.12971E-02 67821 0.341E-01 0.109E-01
DAV: 3 -0.360247486727E+03 0.77164E-04 -0.31372E-04 70602 0.697E-02 0.635E-02
DAV: 4 -0.360247475581E+03 0.11145E-04 -0.16278E-04 66309 0.507E-02 0.172E-02
DAV: 5 -0.360247475813E+03 -0.23148E-06 -0.28445E-05 51324 0.213E-02
694 F= -.36024748E+03 E0= -.36025170E+03 d E =-.130642E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360247115299E+03 0.36028E-03 -0.53723E-01 57720 0.244E+00 0.166E-01
DAV: 2 -0.360247974318E+03 -0.85902E-03 -0.11037E-02 67821 0.314E-01 0.100E-01
DAV: 3 -0.360247908134E+03 0.66184E-04 -0.26647E-04 70692 0.642E-02 0.584E-02
DAV: 4 -0.360247898511E+03 0.96230E-05 -0.13744E-04 66309 0.466E-02 0.158E-02
DAV: 5 -0.360247898741E+03 -0.22963E-06 -0.23844E-05 50001 0.195E-02
695 F= -.36024790E+03 E0= -.36025212E+03 d E =-.172935E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360247828615E+03 0.69896E-04 -0.75347E-01 57720 0.289E+00 0.197E-01
DAV: 2 -0.360249036051E+03 -0.12074E-02 -0.15586E-02 65913 0.371E-01 0.120E-01
DAV: 3 -0.360248947771E+03 0.88280E-04 -0.36830E-04 69423 0.773E-02 0.696E-02
DAV: 4 -0.360248936344E+03 0.11427E-04 -0.20456E-04 66255 0.566E-02 0.188E-02
DAV: 5 -0.360248936554E+03 -0.20955E-06 -0.35980E-05 54960 0.242E-02
696 F= -.36024894E+03 E0= -.36025316E+03 d E =-.103781E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360248785996E+03 0.15035E-03 -0.19630E-01 57720 0.148E+00 0.101E-01
DAV: 2 -0.360249105178E+03 -0.31918E-03 -0.40746E-03 65976 0.190E-01 0.611E-02
DAV: 3 -0.360249083269E+03 0.21910E-04 -0.93926E-05 69447 0.393E-02 0.357E-02
DAV: 4 -0.360249080929E+03 0.23402E-05 -0.53622E-05 63537 0.290E-02
697 F= -.36024908E+03 E0= -.36025330E+03 d E =-.118219E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360249138882E+03 -0.55613E-04 -0.82531E-01 57720 0.303E+00 0.204E-01
DAV: 2 -0.360250450424E+03 -0.13115E-02 -0.16822E-02 67029 0.386E-01 0.123E-01
DAV: 3 -0.360250352440E+03 0.97984E-04 -0.35100E-04 71583 0.796E-02 0.710E-02
DAV: 4 -0.360250344319E+03 0.81203E-05 -0.22554E-04 65940 0.575E-02 0.188E-02
DAV: 5 -0.360250343240E+03 0.10799E-05 -0.37298E-05 57048 0.244E-02
698 F= -.36025034E+03 E0= -.36025457E+03 d E =-.126231E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360250348597E+03 -0.42776E-05 -0.25035E-01 57720 0.167E+00 0.112E-01
DAV: 2 -0.360250755209E+03 -0.40661E-03 -0.51168E-03 67002 0.212E-01 0.677E-02
DAV: 3 -0.360250726228E+03 0.28981E-04 -0.10240E-04 71538 0.435E-02 0.390E-02
DAV: 4 -0.360250724354E+03 0.18740E-05 -0.68567E-05 65922 0.315E-02
699 F= -.36025072E+03 E0= -.36025495E+03 d E =-.164343E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360249344427E+03 0.13818E-02 -0.10020E+00 57720 0.334E+00 0.225E-01
DAV: 2 -0.360250940863E+03 -0.15964E-02 -0.20456E-02 67020 0.425E-01 0.136E-01
DAV: 3 -0.360250821701E+03 0.11916E-03 -0.42425E-04 71592 0.875E-02 0.783E-02
DAV: 4 -0.360250812062E+03 0.96388E-05 -0.27834E-04 65922 0.639E-02 0.208E-02
DAV: 5 -0.360250810497E+03 0.15650E-05 -0.46649E-05 59307 0.273E-02
700 F= -.36025081E+03 E0= -.36025504E+03 d E =-.172957E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360250447005E+03 0.36506E-03 -0.30878E-01 57720 0.185E+00 0.123E-01
DAV: 2 -0.360250917023E+03 -0.47002E-03 -0.61778E-03 66876 0.234E-01 0.750E-02
DAV: 3 -0.360250878532E+03 0.38492E-04 -0.13549E-04 71412 0.480E-02 0.424E-02
DAV: 4 -0.360250874047E+03 0.44849E-05 -0.78408E-05 66057 0.340E-02
701 F= -.36025087E+03 E0= -.36025510E+03 d E =-.179312E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360250771037E+03 0.10749E-03 -0.76689E-02 57726 0.925E-01 0.591E-02
DAV: 2 -0.360250888615E+03 -0.11758E-03 -0.15327E-03 66768 0.116E-01 0.368E-02
DAV: 3 -0.360250878160E+03 0.10455E-04 -0.30636E-05 56805 0.234E-02 0.206E-02
DAV: 4 -0.360250876792E+03 0.13686E-05 -0.20029E-05 41136 0.172E-02
702 F= -.36025088E+03 E0= -.36025510E+03 d E =-.179586E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360250825297E+03 0.52864E-04 -0.80239E-01 57720 0.298E+00 0.197E-01
DAV: 2 -0.360252086998E+03 -0.12617E-02 -0.15975E-02 66768 0.376E-01 0.121E-01
DAV: 3 -0.360251988307E+03 0.98691E-04 -0.31827E-04 71835 0.770E-02 0.693E-02
DAV: 4 -0.360251979671E+03 0.86360E-05 -0.21872E-04 66003 0.566E-02 0.173E-02
DAV: 5 -0.360251979053E+03 0.61847E-06 -0.37309E-05 57399 0.247E-02
703 F= -.36025198E+03 E0= -.36025621E+03 d E =-.110226E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360251841502E+03 0.13817E-03 -0.41051E-01 57720 0.213E+00 0.141E-01
DAV: 2 -0.360252495890E+03 -0.65439E-03 -0.81875E-03 66849 0.269E-01 0.862E-02
DAV: 3 -0.360252446906E+03 0.48984E-04 -0.15880E-04 71763 0.549E-02 0.496E-02
DAV: 4 -0.360252443411E+03 0.34954E-05 -0.11177E-04 65922 0.403E-02 0.124E-02
DAV: 5 -0.360252442837E+03 0.57350E-06 -0.18027E-05 43719 0.179E-02
704 F= -.36025244E+03 E0= -.36025667E+03 d E =-.156605E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360250189365E+03 0.22540E-02 -0.16411E+00 57720 0.427E+00 0.281E-01
DAV: 2 -0.360252782594E+03 -0.25932E-02 -0.32714E-02 66831 0.538E-01 0.172E-01
DAV: 3 -0.360252579038E+03 0.20356E-03 -0.64327E-04 71817 0.110E-01 0.991E-02
DAV: 4 -0.360252561186E+03 0.17852E-04 -0.44947E-04 65895 0.810E-02 0.247E-02
DAV: 5 -0.360252559864E+03 0.13211E-05 -0.78383E-05 65112 0.355E-02
705 F= -.36025256E+03 E0= -.36025679E+03 d E =-.168307E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360252183849E+03 0.37734E-03 -0.33730E-01 57720 0.194E+00 0.126E-01
DAV: 2 -0.360252691399E+03 -0.50755E-03 -0.65971E-03 66408 0.242E-01 0.780E-02
DAV: 3 -0.360252646670E+03 0.44729E-04 -0.13876E-04 71736 0.497E-02 0.440E-02
DAV: 4 -0.360252641187E+03 0.54832E-05 -0.88105E-05 66048 0.359E-02
706 F= -.36025264E+03 E0= -.36025687E+03 d E =-.176439E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360252467834E+03 0.17884E-03 -0.10998E+00 57720 0.350E+00 0.229E-01
DAV: 2 -0.360254239176E+03 -0.17713E-02 -0.22353E-02 66183 0.445E-01 0.140E-01
DAV: 3 -0.360254099528E+03 0.13965E-03 -0.47207E-04 70638 0.896E-02 0.801E-02
DAV: 4 -0.360254083045E+03 0.16483E-04 -0.28419E-04 66660 0.655E-02 0.197E-02
DAV: 5 -0.360254083552E+03 -0.50622E-06 -0.51511E-05 62313 0.289E-02
707 F= -.36025408E+03 E0= -.36025831E+03 d E =-.144236E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360253883717E+03 0.19933E-03 -0.31119E-01 57720 0.186E+00 0.125E-01
DAV: 2 -0.360254397172E+03 -0.51346E-03 -0.63662E-03 66291 0.237E-01 0.749E-02
DAV: 3 -0.360254361810E+03 0.35363E-04 -0.13057E-04 70656 0.478E-02 0.430E-02
DAV: 4 -0.360254359519E+03 0.22903E-05 -0.81193E-05 66246 0.350E-02
708 F= -.36025436E+03 E0= -.36025859E+03 d E =-.171833E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360254459389E+03 -0.97579E-04 -0.63229E-01 57720 0.266E+00 0.181E-01
DAV: 2 -0.360255488261E+03 -0.10289E-02 -0.13178E-02 67569 0.345E-01 0.109E-01
DAV: 3 -0.360255405969E+03 0.82292E-04 -0.31583E-04 71385 0.719E-02 0.634E-02
DAV: 4 -0.360255396176E+03 0.97929E-05 -0.17348E-04 66030 0.510E-02 0.172E-02
DAV: 5 -0.360255396021E+03 0.15550E-06 -0.28290E-05 51459 0.221E-02
709 F= -.36025540E+03 E0= -.36025963E+03 d E =-.103650E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360255416566E+03 -0.20390E-04 -0.30726E-02 57798 0.586E-01 0.404E-02
DAV: 2 -0.360255469401E+03 -0.52835E-04 -0.64685E-04 67461 0.761E-02 0.240E-02
DAV: 3 -0.360255465801E+03 0.35999E-05 -0.12381E-05 40776 0.155E-02
710 F= -.36025547E+03 E0= -.36025970E+03 d E =-.110628E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360255259500E+03 0.20990E-03 -0.12164E-01 57720 0.117E+00 0.801E-02
DAV: 2 -0.360255448939E+03 -0.18944E-03 -0.24659E-03 67650 0.150E-01 0.482E-02
DAV: 3 -0.360255434267E+03 0.14671E-04 -0.62241E-05 70566 0.312E-02 0.277E-02
DAV: 4 -0.360255432699E+03 0.15683E-05 -0.31271E-05 52116 0.222E-02
711 F= -.36025543E+03 E0= -.36025966E+03 d E =-.107318E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360255399398E+03 0.34869E-04 -0.57855E-02 57720 0.805E-01 0.525E-02
DAV: 2 -0.360255489667E+03 -0.90269E-04 -0.11842E-03 67353 0.103E-01 0.326E-02
DAV: 3 -0.360255481155E+03 0.85113E-05 -0.27439E-05 52440 0.212E-02
712 F= -.36025548E+03 E0= -.36025971E+03 d E =-.112164E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360255405512E+03 0.84155E-04 -0.58129E-01 57720 0.255E+00 0.164E-01
DAV: 2 -0.360256335717E+03 -0.93021E-03 -0.11940E-02 67416 0.326E-01 0.103E-01
DAV: 3 -0.360256256978E+03 0.78739E-04 -0.25590E-04 71529 0.670E-02 0.598E-02
DAV: 4 -0.360256246285E+03 0.10694E-04 -0.16475E-04 66165 0.494E-02 0.157E-02
DAV: 5 -0.360256246432E+03 -0.14777E-06 -0.27360E-05 50199 0.213E-02
713 F= -.36025625E+03 E0= -.36026048E+03 d E =-.765277E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360256199965E+03 0.46319E-04 -0.85986E-02 57720 0.981E-01 0.647E-02
DAV: 2 -0.360256339819E+03 -0.13985E-03 -0.17608E-03 67497 0.125E-01 0.400E-02
DAV: 3 -0.360256329230E+03 0.10588E-04 -0.35132E-05 59001 0.259E-02 0.233E-02
DAV: 4 -0.360256328684E+03 0.54601E-06 -0.26403E-05 51738 0.197E-02
714 F= -.36025633E+03 E0= -.36026056E+03 d E =-.847529E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360256464487E+03 -0.13526E-03 -0.45357E-01 57720 0.226E+00 0.149E-01
DAV: 2 -0.360257184916E+03 -0.72043E-03 -0.93590E-03 68289 0.289E-01 0.921E-02
DAV: 3 -0.360257121629E+03 0.63286E-04 -0.22980E-04 72726 0.633E-02 0.525E-02
DAV: 4 -0.360257115176E+03 0.64537E-05 -0.11700E-04 65778 0.409E-02 0.152E-02
DAV: 5 -0.360257115712E+03 -0.53650E-06 -0.18031E-05 44790 0.170E-02
715 F= -.36025712E+03 E0= -.36026135E+03 d E =-.787028E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360257135171E+03 -0.19996E-04 -0.31150E-02 57762 0.591E-01 0.393E-02
DAV: 2 -0.360257187210E+03 -0.52039E-04 -0.64826E-04 68280 0.758E-02 0.241E-02
DAV: 3 -0.360257182995E+03 0.42151E-05 -0.12657E-05 42522 0.166E-02
716 F= -.36025718E+03 E0= -.36026141E+03 d E =-.854311E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360257462815E+03 -0.27560E-03 -0.22529E-01 57720 0.160E+00 0.106E-01
DAV: 2 -0.360257835030E+03 -0.37222E-03 -0.46812E-03 67929 0.203E-01 0.662E-02
DAV: 3 -0.360257804903E+03 0.30127E-04 -0.11115E-04 72996 0.428E-02 0.372E-02
DAV: 4 -0.360257801275E+03 0.36285E-05 -0.51453E-05 64041 0.281E-02
717 F= -.36025780E+03 E0= -.36026203E+03 d E =-.618279E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360257830323E+03 -0.25420E-04 -0.28858E-02 57762 0.572E-01 0.392E-02
DAV: 2 -0.360257880499E+03 -0.50176E-04 -0.61092E-04 68109 0.734E-02 0.239E-02
DAV: 3 -0.360257876887E+03 0.36123E-05 -0.12026E-05 42945 0.158E-02
718 F= -.36025788E+03 E0= -.36026211E+03 d E =-.693892E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360258062186E+03 -0.18169E-03 -0.24965E-01 57720 0.168E+00 0.112E-01
DAV: 2 -0.360258473421E+03 -0.41123E-03 -0.52784E-03 67992 0.217E-01 0.703E-02
DAV: 3 -0.360258439690E+03 0.33731E-04 -0.12739E-04 71565 0.445E-02 0.407E-02
DAV: 4 -0.360258435447E+03 0.42424E-05 -0.66986E-05 65517 0.318E-02
719 F= -.36025844E+03 E0= -.36026267E+03 d E =-.558560E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360258455766E+03 -0.16076E-04 -0.58603E-03 57888 0.257E-01 0.192E-02
DAV: 2 -0.360258466606E+03 -0.10840E-04 -0.13143E-04 68019 0.343E-02 0.115E-02
DAV: 3 -0.360258465927E+03 0.67863E-06 -0.26127E-06 34980 0.775E-03
720 F= -.36025847E+03 E0= -.36026270E+03 d E =-.589040E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360258450087E+03 0.16519E-04 -0.22746E-02 57732 0.507E-01 0.345E-02
DAV: 2 -0.360258486816E+03 -0.36729E-04 -0.47635E-04 68055 0.654E-02 0.215E-02
DAV: 3 -0.360258483768E+03 0.30485E-05 -0.10329E-05 40353 0.135E-02
721 F= -.36025848E+03 E0= -.36026272E+03 d E =-.606881E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360258644864E+03 -0.15805E-03 -0.13694E-01 57720 0.124E+00 0.823E-02
DAV: 2 -0.360258855283E+03 -0.21042E-03 -0.27292E-03 67470 0.156E-01 0.511E-02
DAV: 3 -0.360258838534E+03 0.16750E-04 -0.66277E-05 70386 0.324E-02 0.292E-02
DAV: 4 -0.360258837148E+03 0.13860E-05 -0.33764E-05 58866 0.225E-02
722 F= -.36025884E+03 E0= -.36026307E+03 d E =-.353380E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360258852073E+03 -0.13539E-04 -0.75790E-02 57732 0.918E-01 0.616E-02
DAV: 2 -0.360258974205E+03 -0.12213E-03 -0.15486E-03 67416 0.118E-01 0.380E-02
DAV: 3 -0.360258964868E+03 0.93364E-05 -0.33802E-05 58686 0.244E-02
723 F= -.36025896E+03 E0= -.36026320E+03 d E =-.481101E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360258455459E+03 0.51875E-03 -0.29985E-01 57720 0.183E+00 0.123E-01
DAV: 2 -0.360258912665E+03 -0.45721E-03 -0.59628E-03 67515 0.231E-01 0.764E-02
DAV: 3 -0.360258875915E+03 0.36749E-04 -0.14647E-04 71295 0.481E-02 0.434E-02
DAV: 4 -0.360258873107E+03 0.28084E-05 -0.73817E-05 65958 0.330E-02
724 F= -.36025887E+03 E0= -.36026310E+03 d E =-.389339E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360258757222E+03 0.11869E-03 -0.16559E-01 57720 0.136E+00 0.871E-02
DAV: 2 -0.360259011568E+03 -0.25435E-03 -0.33317E-03 67137 0.172E-01 0.553E-02
DAV: 3 -0.360258987839E+03 0.23729E-04 -0.78725E-05 70287 0.350E-02 0.312E-02
DAV: 4 -0.360258984425E+03 0.34140E-05 -0.39553E-05 59397 0.242E-02
725 F= -.36025898E+03 E0= -.36026322E+03 d E =-.500657E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360259287679E+03 -0.29984E-03 -0.99316E-02 57720 0.106E+00 0.664E-02
DAV: 2 -0.360259445093E+03 -0.15741E-03 -0.20406E-03 67065 0.134E-01 0.427E-02
DAV: 3 -0.360259428924E+03 0.16169E-04 -0.48540E-05 67236 0.285E-02 0.236E-02
DAV: 4 -0.360259426531E+03 0.23932E-05 -0.24977E-05 48093 0.192E-02
726 F= -.36025943E+03 E0= -.36026366E+03 d E =-.442106E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360259495191E+03 -0.66267E-04 -0.85671E-02 57720 0.981E-01 0.641E-02
DAV: 2 -0.360259635089E+03 -0.13990E-03 -0.17739E-03 67164 0.125E-01 0.402E-02
DAV: 3 -0.360259622357E+03 0.12733E-04 -0.39986E-05 60792 0.270E-02 0.227E-02
DAV: 4 -0.360259621087E+03 0.12701E-05 -0.25010E-05 48372 0.190E-02
727 F= -.36025962E+03 E0= -.36026385E+03 d E =-.636662E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360259869382E+03 -0.24702E-03 -0.78359E-02 57723 0.949E-01 0.620E-02
DAV: 2 -0.360260013478E+03 -0.14410E-03 -0.17747E-03 67983 0.124E-01 0.409E-02
DAV: 3 -0.360259998830E+03 0.14648E-04 -0.45267E-05 65193 0.279E-02 0.236E-02
DAV: 4 -0.360259996092E+03 0.27379E-05 -0.22361E-05 42693 0.184E-02
728 F= -.36026000E+03 E0= -.36026423E+03 d E =-.375005E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360260009485E+03 -0.10655E-04 -0.10942E-02 57780 0.355E-01 0.241E-02
DAV: 2 -0.360260029627E+03 -0.20141E-04 -0.24548E-04 68163 0.463E-02 0.153E-02
DAV: 3 -0.360260027741E+03 0.18862E-05 -0.53656E-06 37365 0.104E-02
729 F= -.36026003E+03 E0= -.36026426E+03 d E =-.406654E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360260207539E+03 -0.17791E-03 -0.74403E-02 57720 0.918E-01 0.590E-02
DAV: 2 -0.360260319376E+03 -0.11184E-03 -0.14498E-03 67083 0.114E-01 0.373E-02
DAV: 3 -0.360260309780E+03 0.95960E-05 -0.37411E-05 60234 0.242E-02
730 F= -.36026031E+03 E0= -.36026454E+03 d E =-.282039E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360260319556E+03 -0.18047E-06 -0.41243E-02 57726 0.683E-01 0.463E-02
DAV: 2 -0.360260378108E+03 -0.58552E-04 -0.77123E-04 67407 0.834E-02 0.290E-02
DAV: 3 -0.360260373177E+03 0.49311E-05 -0.19327E-05 47373 0.181E-02
731 F= -.36026037E+03 E0= -.36026460E+03 d E =-.345436E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360260554284E+03 -0.17618E-03 -0.60724E-02 57720 0.825E-01 0.553E-02
DAV: 2 -0.360260652140E+03 -0.97857E-04 -0.12913E-03 66741 0.108E-01 0.349E-02
DAV: 3 -0.360260643761E+03 0.83799E-05 -0.37499E-05 60765 0.224E-02
732 F= -.36026064E+03 E0= -.36026488E+03 d E =-.270584E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360260656454E+03 -0.43134E-05 -0.17895E-02 57762 0.448E-01 0.326E-02
DAV: 2 -0.360260682595E+03 -0.26141E-04 -0.35957E-04 67335 0.573E-02 0.204E-02
DAV: 3 -0.360260680121E+03 0.24740E-05 -0.10741E-05 38598 0.126E-02
733 F= -.36026068E+03 E0= -.36026491E+03 d E =-.306944E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360260868235E+03 -0.18564E-03 -0.35466E-02 57720 0.630E-01 0.416E-02
DAV: 2 -0.360260927558E+03 -0.59323E-04 -0.74813E-04 66579 0.814E-02 0.265E-02
DAV: 3 -0.360260922943E+03 0.46153E-05 -0.16317E-05 44169 0.165E-02
734 F= -.36026092E+03 E0= -.36026515E+03 d E =-.242822E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360260885926E+03 0.41632E-04 -0.14326E-01 57720 0.127E+00 0.829E-02
DAV: 2 -0.360261123934E+03 -0.23801E-03 -0.30207E-03 66588 0.164E-01 0.531E-02
DAV: 3 -0.360261105650E+03 0.18284E-04 -0.75293E-05 71664 0.332E-02 0.301E-02
DAV: 4 -0.360261103179E+03 0.24706E-05 -0.32696E-05 56922 0.214E-02
735 F= -.36026110E+03 E0= -.36026533E+03 d E =-.423058E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360261280941E+03 -0.17529E-03 -0.40932E-02 57735 0.676E-01 0.434E-02
DAV: 2 -0.360261348214E+03 -0.67274E-04 -0.81923E-04 66129 0.848E-02 0.270E-02
DAV: 3 -0.360261343831E+03 0.43830E-05 -0.16705E-05 45048 0.173E-02
736 F= -.36026134E+03 E0= -.36026557E+03 d E =-.240652E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360261032856E+03 0.31536E-03 -0.36574E-01 57720 0.202E+00 0.129E-01
DAV: 2 -0.360261615148E+03 -0.58229E-03 -0.72281E-03 66174 0.252E-01 0.809E-02
DAV: 3 -0.360261573736E+03 0.41412E-04 -0.16613E-04 70710 0.501E-02 0.434E-02
DAV: 4 -0.360261571536E+03 0.21994E-05 -0.64787E-05 66381 0.302E-02
737 F= -.36026157E+03 E0= -.36026580E+03 d E =-.468357E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360261530917E+03 0.42819E-04 -0.35573E-02 57720 0.631E-01 0.379E-02
DAV: 2 -0.360261586333E+03 -0.55416E-04 -0.71650E-04 66075 0.794E-02 0.249E-02
DAV: 3 -0.360261580899E+03 0.54337E-05 -0.14693E-05 41946 0.155E-02
738 F= -.36026158E+03 E0= -.36026581E+03 d E =-.477720E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360261789530E+03 -0.20320E-03 -0.45900E-02 57720 0.723E-01 0.442E-02
DAV: 2 -0.360261871005E+03 -0.81476E-04 -0.10116E-03 68523 0.952E-02 0.282E-02
DAV: 3 -0.360261863232E+03 0.77738E-05 -0.20549E-05 47733 0.187E-02
739 F= -.36026186E+03 E0= -.36026609E+03 d E =-.282333E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360261888137E+03 -0.17132E-04 -0.53482E-02 57720 0.779E-01 0.511E-02
DAV: 2 -0.360261974357E+03 -0.86220E-04 -0.10860E-03 69342 0.984E-02 0.319E-02
DAV: 3 -0.360261966261E+03 0.80957E-05 -0.23223E-05 50298 0.200E-02
740 F= -.36026197E+03 E0= -.36026620E+03 d E =-.385362E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360262129823E+03 -0.15547E-03 -0.59705E-02 57720 0.824E-01 0.535E-02
DAV: 2 -0.360262228141E+03 -0.98318E-04 -0.12128E-03 66741 0.104E-01 0.348E-02
DAV: 3 -0.360262219670E+03 0.84706E-05 -0.26767E-05 53178 0.235E-02
741 F= -.36026222E+03 E0= -.36026645E+03 d E =-.253409E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360262192487E+03 0.35653E-04 -0.79885E-02 57720 0.954E-01 0.623E-02
DAV: 2 -0.360262322067E+03 -0.12958E-03 -0.16131E-03 66903 0.120E-01 0.405E-02
DAV: 3 -0.360262311106E+03 0.10961E-04 -0.36855E-05 60720 0.269E-02 0.231E-02
DAV: 4 -0.360262310644E+03 0.46178E-06 -0.27523E-05 50802 0.197E-02
742 F= -.36026231E+03 E0= -.36026654E+03 d E =-.344383E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360262455526E+03 -0.14442E-03 -0.68075E-02 57720 0.876E-01 0.581E-02
DAV: 2 -0.360262569582E+03 -0.11406E-03 -0.14656E-03 67713 0.116E-01 0.359E-02
DAV: 3 -0.360262561476E+03 0.81059E-05 -0.35923E-05 59568 0.243E-02
743 F= -.36026256E+03 E0= -.36026679E+03 d E =-.250832E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360262450034E+03 0.11955E-03 -0.14251E-01 57720 0.127E+00 0.865E-02
DAV: 2 -0.360262672259E+03 -0.22222E-03 -0.29504E-03 67929 0.165E-01 0.531E-02
DAV: 3 -0.360262656623E+03 0.15636E-04 -0.82668E-05 70737 0.350E-02 0.304E-02
DAV: 4 -0.360262656629E+03 -0.63446E-08 -0.36437E-05 55401 0.229E-02
744 F= -.36026266E+03 E0= -.36026689E+03 d E =-.345985E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360262642013E+03 0.14609E-04 -0.14052E-02 57732 0.399E-01 0.248E-02
DAV: 2 -0.360262663596E+03 -0.21582E-04 -0.29515E-04 67029 0.519E-02 0.159E-02
DAV: 3 -0.360262661484E+03 0.21113E-05 -0.75323E-06 31749 0.107E-02
745 F= -.36026266E+03 E0= -.36026689E+03 d E =-.350840E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360262832609E+03 -0.16901E-03 -0.50624E-02 57720 0.755E-01 0.487E-02
DAV: 2 -0.360262925577E+03 -0.92968E-04 -0.11658E-03 68424 0.102E-01 0.303E-02
DAV: 3 -0.360262918001E+03 0.75754E-05 -0.26123E-05 47868 0.200E-02
746 F= -.36026292E+03 E0= -.36026715E+03 d E =-.256517E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360262912598E+03 0.12979E-04 -0.56437E-02 57720 0.798E-01 0.561E-02
DAV: 2 -0.360263006315E+03 -0.93717E-04 -0.12236E-03 68667 0.105E-01 0.341E-02
DAV: 3 -0.360262999003E+03 0.73121E-05 -0.33213E-05 57174 0.217E-02
747 F= -.36026300E+03 E0= -.36026723E+03 d E =-.337519E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360263130951E+03 -0.12464E-03 -0.36615E-02 57720 0.646E-01 0.447E-02
DAV: 2 -0.360263191394E+03 -0.60443E-04 -0.77405E-04 68316 0.835E-02 0.286E-02
DAV: 3 -0.360263186383E+03 0.50108E-05 -0.18092E-05 47391 0.191E-02
748 F= -.36026319E+03 E0= -.36026742E+03 d E =-.187380E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360263136018E+03 0.55376E-04 -0.97087E-02 57720 0.105E+00 0.704E-02
DAV: 2 -0.360263300653E+03 -0.16464E-03 -0.20890E-03 68352 0.137E-01 0.456E-02
DAV: 3 -0.360263287331E+03 0.13322E-04 -0.52549E-05 68541 0.306E-02 0.272E-02
DAV: 4 -0.360263286656E+03 0.67564E-06 -0.33584E-05 58515 0.213E-02
749 F= -.36026329E+03 E0= -.36026751E+03 d E =-.287653E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360263419243E+03 -0.13191E-03 -0.53071E-02 57720 0.777E-01 0.501E-02
DAV: 2 -0.360263510776E+03 -0.91533E-04 -0.11302E-03 68658 0.999E-02 0.318E-02
DAV: 3 -0.360263503501E+03 0.72753E-05 -0.22952E-05 49947 0.225E-02
750 F= -.36026350E+03 E0= -.36026773E+03 d E =-.216845E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360263396526E+03 0.11425E-03 -0.13096E-01 57720 0.122E+00 0.800E-02
DAV: 2 -0.360263609048E+03 -0.21252E-03 -0.26919E-03 68766 0.154E-01 0.505E-02
DAV: 3 -0.360263592539E+03 0.16509E-04 -0.61477E-05 72663 0.338E-02 0.292E-02
DAV: 4 -0.360263592660E+03 -0.12115E-06 -0.33873E-05 58335 0.217E-02
751 F= -.36026359E+03 E0= -.36026782E+03 d E =-.306005E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360263579502E+03 0.13037E-04 -0.13203E-02 57738 0.388E-01 0.233E-02
DAV: 2 -0.360263600498E+03 -0.20996E-04 -0.27436E-04 68505 0.493E-02 0.153E-02
DAV: 3 -0.360263598403E+03 0.20949E-05 -0.53260E-06 31545 0.101E-02
752 F= -.36026360E+03 E0= -.36026783E+03 d E =-.311748E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360263743966E+03 -0.14347E-03 -0.51682E-02 57720 0.768E-01 0.486E-02
DAV: 2 -0.360263841353E+03 -0.97387E-04 -0.12049E-03 68640 0.103E-01 0.300E-02
DAV: 3 -0.360263833081E+03 0.82718E-05 -0.23567E-05 47859 0.201E-02
753 F= -.36026383E+03 E0= -.36026806E+03 d E =-.234678E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360263831741E+03 0.96121E-05 -0.32959E-02 57726 0.613E-01 0.425E-02
DAV: 2 -0.360263887214E+03 -0.55473E-04 -0.71151E-04 68730 0.790E-02 0.256E-02
DAV: 3 -0.360263882608E+03 0.46057E-05 -0.15901E-05 44934 0.162E-02
754 F= -.36026388E+03 E0= -.36026811E+03 d E =-.284205E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360263999655E+03 -0.11244E-03 -0.37685E-02 57720 0.655E-01 0.437E-02
DAV: 2 -0.360264060723E+03 -0.61068E-04 -0.77842E-04 66408 0.841E-02 0.278E-02
DAV: 3 -0.360264055853E+03 0.48702E-05 -0.18745E-05 48525 0.192E-02
755 F= -.36026406E+03 E0= -.36026829E+03 d E =-.173244E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360264041911E+03 0.18812E-04 -0.55547E-02 57720 0.795E-01 0.535E-02
DAV: 2 -0.360264130538E+03 -0.88627E-04 -0.11471E-03 66597 0.103E-01 0.340E-02
DAV: 3 -0.360264123580E+03 0.69576E-05 -0.28949E-05 54030 0.234E-02
756 F= -.36026412E+03 E0= -.36026835E+03 d E =-.240972E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360264236651E+03 -0.10611E-03 -0.24168E-02 57732 0.522E-01 0.372E-02
DAV: 2 -0.360264273475E+03 -0.36825E-04 -0.51457E-04 67092 0.703E-02 0.230E-02
DAV: 3 -0.360264270769E+03 0.27066E-05 -0.16075E-05 44169 0.158E-02
757 F= -.36026427E+03 E0= -.36026850E+03 d E =-.147189E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360264280357E+03 -0.68814E-05 -0.21747E-02 57720 0.495E-01 0.348E-02
DAV: 2 -0.360264314553E+03 -0.34196E-04 -0.46378E-04 68019 0.661E-02 0.217E-02
DAV: 3 -0.360264311915E+03 0.26383E-05 -0.12851E-05 42360 0.147E-02
758 F= -.36026431E+03 E0= -.36026854E+03 d E =-.188334E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360264414447E+03 -0.99894E-04 -0.26497E-02 57720 0.546E-01 0.373E-02
DAV: 2 -0.360264461483E+03 -0.47036E-04 -0.58844E-04 68451 0.716E-02 0.224E-02
DAV: 3 -0.360264458160E+03 0.33229E-05 -0.15083E-05 45195 0.144E-02
759 F= -.36026446E+03 E0= -.36026869E+03 d E =-.146245E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360264451722E+03 0.97609E-05 -0.37859E-02 57720 0.652E-01 0.445E-02
DAV: 2 -0.360264518629E+03 -0.66907E-04 -0.82968E-04 68082 0.848E-02 0.269E-02
DAV: 3 -0.360264513649E+03 0.49798E-05 -0.20158E-05 47355 0.168E-02
760 F= -.36026451E+03 E0= -.36026874E+03 d E =-.201734E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360264610066E+03 -0.91438E-04 -0.33044E-02 57720 0.612E-01 0.410E-02
DAV: 2 -0.360264666759E+03 -0.56693E-04 -0.71032E-04 66372 0.785E-02 0.258E-02
DAV: 3 -0.360264662015E+03 0.47433E-05 -0.17219E-05 45177 0.177E-02
761 F= -.36026466E+03 E0= -.36026889E+03 d E =-.148366E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360264667495E+03 -0.73663E-06 -0.11345E-02 57756 0.359E-01 0.250E-02
DAV: 2 -0.360264686219E+03 -0.18723E-04 -0.23371E-04 66696 0.451E-02 0.154E-02
DAV: 3 -0.360264684791E+03 0.14279E-05 -0.53277E-06 38112 0.101E-02
762 F= -.36026468E+03 E0= -.36026892E+03 d E =-.171142E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360264768770E+03 -0.82551E-04 -0.23969E-02 57726 0.525E-01 0.344E-02
DAV: 2 -0.360264813161E+03 -0.44391E-04 -0.54765E-04 66300 0.690E-02 0.227E-02
DAV: 3 -0.360264809158E+03 0.40036E-05 -0.12639E-05 42045 0.161E-02
763 F= -.36026481E+03 E0= -.36026904E+03 d E =-.124367E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360264813196E+03 -0.35097E-07 -0.91187E-03 57756 0.323E-01 0.228E-02
DAV: 2 -0.360264828767E+03 -0.15571E-04 -0.19631E-04 66885 0.416E-02 0.148E-02
DAV: 3 -0.360264827441E+03 0.13262E-05 -0.45056E-06 36555 0.968E-03
764 F= -.36026483E+03 E0= -.36026906E+03 d E =-.142650E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360264891550E+03 -0.62783E-04 -0.27743E-02 57726 0.561E-01 0.373E-02
DAV: 2 -0.360264942024E+03 -0.50474E-04 -0.63431E-04 68613 0.743E-02 0.227E-02
DAV: 3 -0.360264938033E+03 0.39915E-05 -0.15370E-05 44466 0.148E-02
765 F= -.36026494E+03 E0= -.36026917E+03 d E =-.110592E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360264938230E+03 0.37944E-05 -0.67293E-03 57804 0.276E-01 0.202E-02
DAV: 2 -0.360264949249E+03 -0.11019E-04 -0.14274E-04 69612 0.352E-02 0.122E-02
DAV: 3 -0.360264948367E+03 0.88122E-06 -0.37570E-06 34962 0.747E-03
766 F= -.36026495E+03 E0= -.36026918E+03 d E =-.120926E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360265016893E+03 -0.67645E-04 -0.28534E-02 57726 0.566E-01 0.379E-02
DAV: 2 -0.360265065713E+03 -0.48820E-04 -0.61618E-04 66327 0.740E-02 0.233E-02
DAV: 3 -0.360265062079E+03 0.36340E-05 -0.14904E-05 44259 0.154E-02
767 F= -.36026506E+03 E0= -.36026929E+03 d E =-.113712E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360265061439E+03 0.42744E-05 -0.14225E-02 57726 0.400E-01 0.285E-02
DAV: 2 -0.360265083972E+03 -0.22533E-04 -0.29385E-04 67416 0.514E-02 0.171E-02
DAV: 3 -0.360265082395E+03 0.15767E-05 -0.75498E-06 37971 0.110E-02
768 F= -.36026508E+03 E0= -.36026931E+03 d E =-.134028E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360265152679E+03 -0.68707E-04 -0.24889E-02 57726 0.532E-01 0.357E-02
DAV: 2 -0.360265197008E+03 -0.44329E-04 -0.55647E-04 66192 0.704E-02 0.234E-02
DAV: 3 -0.360265193373E+03 0.36353E-05 -0.11818E-05 42387 0.155E-02
769 F= -.36026519E+03 E0= -.36026942E+03 d E =-.110978E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360265189452E+03 0.75562E-05 -0.18839E-02 57726 0.463E-01 0.322E-02
DAV: 2 -0.360265221036E+03 -0.31584E-04 -0.40962E-04 66471 0.611E-02 0.206E-02
DAV: 3 -0.360265218671E+03 0.23653E-05 -0.95827E-06 40650 0.135E-02
770 F= -.36026522E+03 E0= -.36026945E+03 d E =-.136276E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360265286499E+03 -0.65463E-04 -0.26630E-02 57726 0.549E-01 0.364E-02
DAV: 2 -0.360265331826E+03 -0.45327E-04 -0.56907E-04 68532 0.703E-02 0.220E-02
DAV: 3 -0.360265328676E+03 0.31505E-05 -0.11563E-05 41001 0.139E-02
771 F= -.36026533E+03 E0= -.36026956E+03 d E =-.110005E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360265301374E+03 0.30452E-04 -0.46197E-02 57720 0.722E-01 0.473E-02
DAV: 2 -0.360265380486E+03 -0.79111E-04 -0.97685E-04 68514 0.916E-02 0.288E-02
DAV: 3 -0.360265374872E+03 0.56136E-05 -0.18339E-05 48192 0.179E-02
772 F= -.36026537E+03 E0= -.36026961E+03 d E =-.156201E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360265433086E+03 -0.52600E-04 -0.40207E-02 57720 0.676E-01 0.443E-02
DAV: 2 -0.360265501574E+03 -0.68488E-04 -0.85258E-04 68496 0.857E-02 0.271E-02
DAV: 3 -0.360265496473E+03 0.51012E-05 -0.17577E-05 46329 0.171E-02
773 F= -.36026550E+03 E0= -.36026973E+03 d E =-.121601E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360265490311E+03 0.11263E-04 -0.17825E-02 57726 0.450E-01 0.302E-02
DAV: 2 -0.360265520091E+03 -0.29780E-04 -0.36888E-04 68784 0.563E-02 0.183E-02
DAV: 3 -0.360265517939E+03 0.21518E-05 -0.72580E-06 38346 0.112E-02
774 F= -.36026552E+03 E0= -.36026975E+03 d E =-.143067E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360265585000E+03 -0.64909E-04 -0.39697E-02 57720 0.673E-01 0.434E-02
DAV: 2 -0.360265654757E+03 -0.69757E-04 -0.85661E-04 67092 0.860E-02 0.285E-02
DAV: 3 -0.360265649168E+03 0.55894E-05 -0.17014E-05 48687 0.194E-02
775 F= -.36026565E+03 E0= -.36026988E+03 d E =-.131228E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360265637229E+03 0.17528E-04 -0.25369E-02 57726 0.538E-01 0.366E-02
DAV: 2 -0.360265679007E+03 -0.41777E-04 -0.52929E-04 67236 0.683E-02 0.235E-02
DAV: 3 -0.360265675812E+03 0.31951E-05 -0.10689E-05 41874 0.154E-02
776 F= -.36026568E+03 E0= -.36026991E+03 d E =-.157872E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360265740929E+03 -0.61922E-04 -0.48985E-02 57720 0.744E-01 0.501E-02
DAV: 2 -0.360265819570E+03 -0.78641E-04 -0.10199E-03 67002 0.954E-02 0.302E-02
DAV: 3 -0.360265814719E+03 0.48514E-05 -0.24435E-05 52107 0.202E-02
777 F= -.36026581E+03 E0= -.36027005E+03 d E =-.138907E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360265778308E+03 0.41262E-04 -0.51859E-02 57720 0.765E-01 0.527E-02
DAV: 2 -0.360265860140E+03 -0.81831E-04 -0.10645E-03 67011 0.974E-02 0.317E-02
DAV: 3 -0.360265855121E+03 0.50188E-05 -0.25217E-05 52626 0.207E-02
778 F= -.36026586E+03 E0= -.36027009E+03 d E =-.179309E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360265890449E+03 -0.30309E-04 -0.58345E-02 57720 0.811E-01 0.560E-02
DAV: 2 -0.360265991079E+03 -0.10063E-03 -0.12719E-03 67389 0.105E-01 0.330E-02
DAV: 3 -0.360265984521E+03 0.65586E-05 -0.32345E-05 57129 0.213E-02
779 F= -.36026598E+03 E0= -.36027022E+03 d E =-.129399E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360265975403E+03 0.15676E-04 -0.16561E-02 57726 0.432E-01 0.318E-02
DAV: 2 -0.360266001889E+03 -0.26486E-04 -0.34368E-04 67497 0.548E-02 0.186E-02
DAV: 3 -0.360266000174E+03 0.17143E-05 -0.89060E-06 38418 0.115E-02
780 F= -.36026600E+03 E0= -.36027024E+03 d E =-.145053E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360266070321E+03 -0.68432E-04 -0.44906E-02 57720 0.710E-01 0.470E-02
DAV: 2 -0.360266142237E+03 -0.71915E-04 -0.91597E-04 67587 0.900E-02 0.291E-02
DAV: 3 -0.360266136431E+03 0.58051E-05 -0.19759E-05 49182 0.197E-02
781 F= -.36026614E+03 E0= -.36027037E+03 d E =-.136257E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360266120945E+03 0.21292E-04 -0.33869E-02 57726 0.617E-01 0.424E-02
DAV: 2 -0.360266172884E+03 -0.51940E-04 -0.67481E-04 67785 0.778E-02 0.258E-02
DAV: 3 -0.360266168938E+03 0.39462E-05 -0.15142E-05 45492 0.171E-02
782 F= -.36026617E+03 E0= -.36027040E+03 d E =-.168764E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360266219895E+03 -0.47011E-04 -0.50558E-02 57720 0.756E-01 0.505E-02
DAV: 2 -0.360266302340E+03 -0.82444E-04 -0.10361E-03 67623 0.956E-02 0.311E-02
DAV: 3 -0.360266296232E+03 0.61071E-05 -0.21995E-05 50820 0.213E-02
783 F= -.36026630E+03 E0= -.36027053E+03 d E =-.127294E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360266281597E+03 0.20743E-04 -0.26121E-02 57726 0.543E-01 0.377E-02
DAV: 2 -0.360266322495E+03 -0.40898E-04 -0.52170E-04 68073 0.681E-02 0.230E-02
DAV: 3 -0.360266319593E+03 0.29018E-05 -0.10755E-05 40866 0.153E-02
784 F= -.36026632E+03 E0= -.36027056E+03 d E =-.150655E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360266339675E+03 -0.17180E-04 -0.56651E-02 57720 0.802E-01 0.535E-02
DAV: 2 -0.360266439500E+03 -0.99825E-04 -0.12428E-03 68415 0.104E-01 0.321E-02
DAV: 3 -0.360266432279E+03 0.72212E-05 -0.25978E-05 51171 0.202E-02
785 F= -.36026643E+03 E0= -.36027067E+03 d E =-.112686E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360266429548E+03 0.99521E-05 -0.30977E-03 58023 0.187E-01 0.150E-02
DAV: 2 -0.360266433796E+03 -0.42484E-05 -0.57765E-05 62565 0.227E-02
786 F= -.36026643E+03 E0= -.36027067E+03 d E =-.114204E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360266481841E+03 -0.52293E-04 -0.42633E-02 57720 0.692E-01 0.484E-02
DAV: 2 -0.360266550468E+03 -0.68627E-04 -0.89455E-04 67182 0.889E-02 0.295E-02
DAV: 3 -0.360266545095E+03 0.53727E-05 -0.20315E-05 47109 0.193E-02
787 F= -.36026655E+03 E0= -.36027078E+03 d E =-.111299E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360266523445E+03 0.27023E-04 -0.31742E-02 57726 0.598E-01 0.418E-02
DAV: 2 -0.360266572913E+03 -0.49468E-04 -0.64527E-04 67641 0.760E-02 0.247E-02
DAV: 3 -0.360266569713E+03 0.31999E-05 -0.14800E-05 42429 0.162E-02
788 F= -.36026657E+03 E0= -.36027081E+03 d E =-.135917E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360266622468E+03 -0.49555E-04 -0.31841E-02 57726 0.600E-01 0.419E-02
DAV: 2 -0.360266675770E+03 -0.53302E-04 -0.69540E-04 66183 0.787E-02 0.261E-02
DAV: 3 -0.360266671677E+03 0.40930E-05 -0.15749E-05 45267 0.178E-02
789 F= -.36026667E+03 E0= -.36027091E+03 d E =-.101964E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360266655896E+03 0.19874E-04 -0.26147E-02 57726 0.544E-01 0.386E-02
DAV: 2 -0.360266698292E+03 -0.42396E-04 -0.56368E-04 66624 0.714E-02 0.239E-02
DAV: 3 -0.360266695175E+03 0.31170E-05 -0.12961E-05 43116 0.160E-02
790 F= -.36026670E+03 E0= -.36027093E+03 d E =-.125462E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360266751381E+03 -0.53089E-04 -0.42281E-02 57726 0.688E-01 0.474E-02
DAV: 2 -0.360266817805E+03 -0.66424E-04 -0.86562E-04 67002 0.879E-02 0.278E-02
DAV: 3 -0.360266813463E+03 0.43420E-05 -0.20688E-05 47922 0.185E-02
791 F= -.36026681E+03 E0= -.36027105E+03 d E =-.118288E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360266779744E+03 0.38061E-04 -0.49671E-02 57720 0.746E-01 0.516E-02
DAV: 2 -0.360266857597E+03 -0.77853E-04 -0.10050E-03 66660 0.942E-02 0.303E-02
DAV: 3 -0.360266852525E+03 0.50714E-05 -0.23059E-05 50466 0.198E-02
792 F= -.36026685E+03 E0= -.36027109E+03 d E =-.157350E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360266869070E+03 -0.11474E-04 -0.60876E-02 57720 0.829E-01 0.568E-02
DAV: 2 -0.360266975519E+03 -0.10645E-03 -0.13160E-03 67722 0.107E-01 0.335E-02
DAV: 3 -0.360266968025E+03 0.74944E-05 -0.28763E-05 55158 0.210E-02
793 F= -.36026697E+03 E0= -.36027121E+03 d E =-.115499E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360266962876E+03 0.12643E-04 -0.73051E-03 57810 0.287E-01 0.219E-02
DAV: 2 -0.360266974221E+03 -0.11345E-04 -0.14527E-04 68028 0.355E-02 0.126E-02
DAV: 3 -0.360266973554E+03 0.66718E-06 -0.35768E-06 34278 0.747E-03
794 F= -.36026697E+03 E0= -.36027121E+03 d E =-.121029E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267002579E+03 -0.28358E-04 -0.61891E-02 57720 0.837E-01 0.553E-02
DAV: 2 -0.360267105213E+03 -0.10263E-03 -0.12874E-03 65535 0.107E-01 0.346E-02
DAV: 3 -0.360267096901E+03 0.83118E-05 -0.28460E-05 55671 0.241E-02
795 F= -.36026710E+03 E0= -.36027134E+03 d E =-.123347E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267091484E+03 0.13729E-04 -0.10229E-02 57732 0.340E-01 0.257E-02
DAV: 2 -0.360267105930E+03 -0.14446E-04 -0.19746E-04 67947 0.428E-02 0.153E-02
DAV: 3 -0.360267104962E+03 0.96842E-06 -0.48589E-06 37116 0.994E-03
796 F= -.36026710E+03 E0= -.36027135E+03 d E =-.131408E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267140016E+03 -0.34086E-04 -0.54552E-02 57720 0.787E-01 0.529E-02
DAV: 2 -0.360267229511E+03 -0.89494E-04 -0.11440E-03 65895 0.101E-01 0.332E-02
DAV: 3 -0.360267222098E+03 0.74121E-05 -0.25301E-05 53961 0.229E-02
797 F= -.36026722E+03 E0= -.36027146E+03 d E =-.117137E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267217694E+03 0.11817E-04 -0.85059E-03 57756 0.311E-01 0.237E-02
DAV: 2 -0.360267229426E+03 -0.11733E-04 -0.16530E-04 67929 0.396E-02 0.141E-02
DAV: 3 -0.360267228725E+03 0.70160E-06 -0.43969E-06 36825 0.910E-03
798 F= -.36026723E+03 E0= -.36027147E+03 d E =-.123763E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267233481E+03 -0.40550E-05 -0.59313E-02 57720 0.820E-01 0.558E-02
DAV: 2 -0.360267336962E+03 -0.10348E-03 -0.13118E-03 68316 0.107E-01 0.329E-02
DAV: 3 -0.360267329353E+03 0.76091E-05 -0.29453E-05 55212 0.212E-02
799 F= -.36026733E+03 E0= -.36027157E+03 d E =-.100628E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267327102E+03 0.98594E-05 -0.24441E-03 58173 0.167E-01 0.144E-02
DAV: 2 -0.360267330015E+03 -0.29125E-05 -0.43637E-05 55104 0.203E-02
800 F= -.36026733E+03 E0= -.36027157E+03 d E =-.101290E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267367275E+03 -0.40173E-04 -0.44988E-02 57720 0.712E-01 0.507E-02
DAV: 2 -0.360267438751E+03 -0.71475E-04 -0.94492E-04 67884 0.918E-02 0.306E-02
DAV: 3 -0.360267432798E+03 0.59525E-05 -0.22318E-05 50313 0.200E-02
801 F= -.36026743E+03 E0= -.36027167E+03 d E =-.102783E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267424900E+03 0.13851E-04 -0.13408E-02 57726 0.389E-01 0.293E-02
DAV: 2 -0.360267444362E+03 -0.19462E-04 -0.26685E-04 68244 0.495E-02 0.169E-02
DAV: 3 -0.360267443105E+03 0.12567E-05 -0.70259E-06 36828 0.109E-02
802 F= -.36026744E+03 E0= -.36027168E+03 d E =-.113090E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267481291E+03 -0.36929E-04 -0.37184E-02 57720 0.648E-01 0.450E-02
DAV: 2 -0.360267542735E+03 -0.61445E-04 -0.79352E-04 65715 0.842E-02 0.290E-02
DAV: 3 -0.360267537223E+03 0.55122E-05 -0.19036E-05 47868 0.198E-02
803 F= -.36026754E+03 E0= -.36027178E+03 d E =-.941182E-04
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267532824E+03 0.99110E-05 -0.10451E-02 57732 0.344E-01 0.262E-02
DAV: 2 -0.360267548215E+03 -0.15391E-04 -0.21348E-04 66597 0.447E-02 0.163E-02
DAV: 3 -0.360267546953E+03 0.12618E-05 -0.55334E-06 35481 0.107E-02
804 F= -.36026755E+03 E0= -.36027179E+03 d E =-.103848E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267588295E+03 -0.40080E-04 -0.37788E-02 57720 0.653E-01 0.450E-02
DAV: 2 -0.360267648629E+03 -0.60334E-04 -0.78039E-04 68334 0.835E-02 0.269E-02
DAV: 3 -0.360267643645E+03 0.49834E-05 -0.17283E-05 46041 0.176E-02
805 F= -.36026764E+03 E0= -.36027189E+03 d E =-.966923E-04
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267639538E+03 0.90907E-05 -0.10637E-02 57732 0.347E-01 0.256E-02
DAV: 2 -0.360267655143E+03 -0.15604E-04 -0.20755E-04 68775 0.433E-02 0.150E-02
DAV: 3 -0.360267654000E+03 0.11429E-05 -0.47955E-06 36897 0.940E-03
806 F= -.36026765E+03 E0= -.36027190E+03 d E =-.107046E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267679461E+03 -0.24319E-04 -0.45835E-02 57720 0.721E-01 0.489E-02
DAV: 2 -0.360267757328E+03 -0.77866E-04 -0.97782E-04 68847 0.924E-02 0.291E-02
DAV: 3 -0.360267751144E+03 0.61838E-05 -0.19686E-05 47913 0.184E-02
807 F= -.36026775E+03 E0= -.36027199E+03 d E =-.971444E-04
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267737973E+03 0.19355E-04 -0.15317E-02 57726 0.417E-01 0.302E-02
DAV: 2 -0.360267762109E+03 -0.24136E-04 -0.30951E-04 69153 0.520E-02 0.176E-02
DAV: 3 -0.360267760387E+03 0.17223E-05 -0.65274E-06 37992 0.105E-02
808 F= -.36026776E+03 E0= -.36027200E+03 d E =-.106387E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267809664E+03 -0.47555E-04 -0.28346E-02 57720 0.566E-01 0.385E-02
DAV: 2 -0.360267853365E+03 -0.43702E-04 -0.56628E-04 67029 0.709E-02 0.245E-02
DAV: 3 -0.360267849204E+03 0.41616E-05 -0.11271E-05 41874 0.167E-02
809 F= -.36026785E+03 E0= -.36027209E+03 d E =-.888173E-04
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267831194E+03 0.22171E-04 -0.33042E-02 57720 0.611E-01 0.425E-02
DAV: 2 -0.360267880554E+03 -0.49360E-04 -0.65500E-04 67425 0.769E-02 0.267E-02
DAV: 3 -0.360267876057E+03 0.44968E-05 -0.13515E-05 43662 0.178E-02
810 F= -.36026788E+03 E0= -.36027212E+03 d E =-.115671E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267931183E+03 -0.50629E-04 -0.27341E-02 57720 0.555E-01 0.391E-02
DAV: 2 -0.360267971951E+03 -0.40768E-04 -0.54905E-04 66219 0.710E-02 0.247E-02
DAV: 3 -0.360267968308E+03 0.36429E-05 -0.13735E-05 44079 0.167E-02
811 F= -.36026797E+03 E0= -.36027221E+03 d E =-.922506E-04
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360267958207E+03 0.13744E-04 -0.25611E-02 57720 0.537E-01 0.380E-02
DAV: 2 -0.360267996472E+03 -0.38265E-04 -0.50976E-04 66624 0.681E-02 0.241E-02
DAV: 3 -0.360267993010E+03 0.34617E-05 -0.11760E-05 41991 0.158E-02
812 F= -.36026799E+03 E0= -.36027224E+03 d E =-.116952E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360268038002E+03 -0.41530E-04 -0.32365E-02 57720 0.603E-01 0.426E-02
DAV: 2 -0.360268090331E+03 -0.52329E-04 -0.68423E-04 68802 0.778E-02 0.249E-02
DAV: 3 -0.360268086145E+03 0.41862E-05 -0.16760E-05 43557 0.157E-02
813 F= -.36026809E+03 E0= -.36027233E+03 d E =-.931346E-04
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360268067594E+03 0.22736E-04 -0.25586E-02 57720 0.536E-01 0.383E-02
DAV: 2 -0.360268108171E+03 -0.40576E-04 -0.52745E-04 68676 0.680E-02 0.225E-02
DAV: 3 -0.360268104839E+03 0.33316E-05 -0.12005E-05 40398 0.137E-02
814 F= -.36026810E+03 E0= -.36027235E+03 d E =-.111829E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360268146293E+03 -0.38122E-04 -0.37309E-02 57720 0.646E-01 0.448E-02
DAV: 2 -0.360268203234E+03 -0.56941E-04 -0.74772E-04 68325 0.813E-02 0.268E-02
DAV: 3 -0.360268198640E+03 0.45948E-05 -0.16022E-05 43800 0.172E-02
815 F= -.36026820E+03 E0= -.36027244E+03 d E =-.938003E-04
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360268176465E+03 0.26770E-04 -0.32786E-02 57720 0.606E-01 0.428E-02
DAV: 2 -0.360268225551E+03 -0.49087E-04 -0.65068E-04 68478 0.761E-02 0.254E-02
DAV: 3 -0.360268221728E+03 0.38240E-05 -0.14277E-05 42621 0.161E-02
816 F= -.36026822E+03 E0= -.36027246E+03 d E =-.116888E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360268272644E+03 -0.47092E-04 -0.35834E-02 57720 0.635E-01 0.443E-02
DAV: 2 -0.360268329021E+03 -0.56377E-04 -0.73483E-04 66228 0.810E-02 0.292E-02
DAV: 3 -0.360268323502E+03 0.55185E-05 -0.16925E-05 44970 0.194E-02
817 F= -.36026832E+03 E0= -.36027257E+03 d E =-.101775E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360268317640E+03 0.11381E-04 -0.15348E-02 57720 0.416E-01 0.303E-02
DAV: 2 -0.360268340279E+03 -0.22640E-04 -0.30768E-04 66426 0.534E-02 0.195E-02
DAV: 3 -0.360268338246E+03 0.20337E-05 -0.73199E-06 37758 0.127E-02
818 F= -.36026834E+03 E0= -.36027258E+03 d E =-.116518E-03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.360268388191E+03 -0.47911E-04 -0.27522E-02 57720 0.557E-01 0.392E-02
DAV: 2 -0.360268430517E+03 -0.42326E-04 -0.56726E-04 68640 0.720E-02 0.234E-02