N E dE d eps ncg rms rms(c) DAV: 1 0.446642491425E+04 0.44664E+04 -0.30705E+05 4224 0.164E+03 DAV: 2 -0.353895697445E+03 -0.48203E+04 -0.47077E+04 5184 0.374E+02 DAV: 3 -0.743169016472E+03 -0.38927E+03 -0.38769E+03 5568 0.113E+02 DAV: 4 -0.751141654095E+03 -0.79726E+01 -0.79519E+01 5760 0.162E+01 DAV: 5 -0.751652030477E+03 -0.51038E+00 -0.51022E+00 6912 0.255E+00 0.133E+02 DAV: 6 -0.673825334136E+03 0.77827E+02 -0.32548E+02 5056 0.292E+01 0.769E+01 DAV: 7 -0.673907640586E+03 -0.82306E-01 -0.21518E+01 5344 0.767E+00 0.124E+01 DAV: 8 -0.673743089804E+03 0.16455E+00 -0.12423E+00 5632 0.220E+00 0.402E+00 DAV: 9 -0.673740445776E+03 0.26440E-02 -0.24016E-01 5216 0.111E+00 0.105E+00 DAV: 10 -0.673748142968E+03 -0.76972E-02 -0.58599E-02 5856 0.573E-01 0.537E-01 DAV: 11 -0.673750787485E+03 -0.26445E-02 -0.11840E-02 5024 0.250E-01 0.256E-01 DAV: 12 -0.673751068239E+03 -0.28075E-03 -0.41689E-03 4992 0.156E-01 0.832E-02 DAV: 13 -0.673751093700E+03 -0.25461E-04 -0.15096E-03 5280 0.972E-02 0.573E-02 DAV: 14 -0.673751111262E+03 -0.17562E-04 -0.55266E-04 5120 0.550E-02 0.335E-02 DAV: 15 -0.673751106172E+03 0.50905E-05 -0.86902E-05 5696 0.224E-02 1 F= -.68589462E+03 E0= -.68589462E+03 d E =-.685895E+03 N E dE d eps ncg rms rms(c) DAV: 1 -0.671976394457E+03 0.17747E+01 -0.47844E+02 4736 0.417E+01 0.152E+01 DAV: 2 -0.672588899032E+03 -0.61250E+00 -0.15167E+01 5344 0.718E+00 0.100E+01 DAV: 3 -0.672311379940E+03 0.27752E+00 -0.12177E+00 5216 0.219E+00 0.584E+00 DAV: 4 -0.672248237284E+03 0.63143E-01 -0.24501E-01 5312 0.108E+00 0.177E+00 DAV: 5 -0.672243919130E+03 0.43182E-02 -0.55505E-02 5600 0.550E-01 0.433E-01 DAV: 6 -0.672243120653E+03 0.79848E-03 -0.15949E-02 5120 0.237E-01 0.254E-01 DAV: 7 -0.672242476803E+03 0.64385E-03 -0.21841E-03 5248 0.961E-02 0.127E-01 DAV: 8 -0.672242334661E+03 0.14214E-03 -0.56712E-04 5120 0.569E-02 0.452E-02 DAV: 9 -0.672242285932E+03 0.48728E-04 -0.15576E-04 5536 0.332E-02 0.257E-02 DAV: 10 -0.672242284014E+03 0.19183E-05 -0.60966E-05 5632 0.172E-02 2 F= -.68428840E+03 E0= -.68428840E+03 d E =0.160622E+01 N E dE d eps ncg rms rms(c) DAV: 1 -0.674394425143E+03 -0.21521E+01 -0.19953E+02 4224 0.271E+01 0.125E+01 DAV: 2 -0.674536113377E+03 -0.14169E+00 -0.64013E+00 5376 0.475E+00 0.520E+00 DAV: 3 -0.674433898500E+03 0.10221E+00 -0.54197E-01 5120 0.154E+00 0.211E+00 DAV: 4 -0.674418849026E+03 0.15049E-01 -0.11160E-01 5344 0.665E-01 0.562E-01 DAV: 5 -0.674417943024E+03 0.90600E-03 -0.10386E-02 5312 0.228E-01 0.258E-01 DAV: 6 -0.674417579052E+03 0.36397E-03 -0.20345E-03 5632 0.917E-02 0.117E-01 DAV: 7 -0.674417443822E+03 0.13523E-03 -0.40300E-04 5344 0.518E-02 0.493E-02 DAV: 8 -0.674417397521E+03 0.46301E-04 -0.17527E-04 5376 0.353E-02 0.233E-02 DAV: 9 -0.674417387103E+03 0.10417E-04 -0.70832E-05 5344 0.229E-02 0.121E-02 DAV: 10 -0.674417387465E+03 -0.36137E-06 -0.14585E-05 3776 0.992E-03 3 F= -.68652580E+03 E0= -.68652580E+03 d E =-.631178E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.675019900965E+03 -0.60251E+00 -0.11574E+02 4352 0.205E+01 0.741E+00 DAV: 2 -0.675017523004E+03 0.23780E-02 -0.30384E+00 5280 0.323E+00 0.394E+00 DAV: 3 -0.674947012678E+03 0.70510E-01 -0.23626E-01 5216 0.986E-01 0.228E+00 DAV: 4 -0.674936943051E+03 0.10070E-01 -0.55843E-02 5376 0.501E-01 0.738E-01 DAV: 5 -0.674936735675E+03 0.20738E-03 -0.79598E-03 5344 0.201E-01 0.201E-01 DAV: 6 -0.674936563299E+03 0.17238E-03 -0.19079E-03 5280 0.927E-02 0.104E-01 DAV: 7 -0.674936514267E+03 0.49032E-04 -0.30498E-04 5376 0.386E-02 0.497E-02 DAV: 8 -0.674936493683E+03 0.20585E-04 -0.77615E-05 5728 0.246E-02 0.191E-02 DAV: 9 -0.674936487764E+03 0.59187E-05 -0.20630E-05 4288 0.124E-02 4 F= -.68693583E+03 E0= -.68693583E+03 d E =-.410029E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.674960950998E+03 -0.24457E-01 -0.66532E+00 4416 0.492E+00 0.189E+00 DAV: 2 -0.674959463577E+03 0.14874E-02 -0.17403E-01 5216 0.776E-01 0.855E-01 DAV: 3 -0.674955629295E+03 0.38343E-02 -0.13572E-02 5248 0.241E-01 0.411E-01 DAV: 4 -0.674955212631E+03 0.41666E-03 -0.31753E-03 5408 0.116E-01 0.148E-01 DAV: 5 -0.674955239064E+03 -0.26434E-04 -0.39254E-04 5312 0.437E-02 0.450E-02 DAV: 6 -0.674955245242E+03 -0.61778E-05 -0.72465E-05 5312 0.185E-02 5 F= -.68698060E+03 E0= -.68698060E+03 d E =-.454803E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.675298768300E+03 -0.34353E+00 -0.89757E+01 4224 0.181E+01 0.543E+00 DAV: 2 -0.675357044338E+03 -0.58276E-01 -0.22890E+00 5184 0.281E+00 0.305E+00 DAV: 3 -0.675317366812E+03 0.39678E-01 -0.98878E-02 5344 0.686E-01 0.147E+00 DAV: 4 -0.675310087695E+03 0.72791E-02 -0.42295E-02 5344 0.406E-01 0.386E-01 DAV: 5 -0.675309713691E+03 0.37400E-03 -0.66613E-03 5856 0.189E-01 0.220E-01 DAV: 6 -0.675309655442E+03 0.58249E-04 -0.11439E-03 5312 0.673E-02 0.823E-02 DAV: 7 -0.675309573959E+03 0.81483E-04 -0.22762E-04 5216 0.366E-02 0.315E-02 DAV: 8 -0.675309567174E+03 0.67855E-05 -0.53966E-05 5120 0.159E-02 6 F= -.68727013E+03 E0= -.68727013E+03 d E =-.289528E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.675311291884E+03 -0.17179E-02 -0.26219E+00 4480 0.310E+00 0.876E-01 DAV: 2 -0.675312942987E+03 -0.16511E-02 -0.68835E-02 5184 0.481E-01 0.556E-01 DAV: 3 -0.675311907371E+03 0.10356E-02 -0.22176E-03 5312 0.104E-01 0.330E-01 DAV: 4 -0.675311600244E+03 0.30713E-03 -0.16738E-03 5440 0.820E-02 0.723E-02 DAV: 5 -0.675311603919E+03 -0.36750E-05 -0.29119E-04 5568 0.375E-02 0.485E-02 DAV: 6 -0.675311609800E+03 -0.58812E-05 -0.51825E-05 5184 0.133E-02 7 F= -.68728328E+03 E0= -.68728328E+03 d E =-.302676E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.675416451435E+03 -0.10485E+00 -0.21570E+01 4224 0.887E+00 0.335E+00 DAV: 2 -0.675444119846E+03 -0.27668E-01 -0.66170E-01 5376 0.150E+00 0.187E+00 DAV: 3 -0.675432629668E+03 0.11490E-01 -0.27647E-02 5248 0.368E-01 0.863E-01 DAV: 4 -0.675430990939E+03 0.16387E-02 -0.11265E-02 5280 0.217E-01 0.213E-01 DAV: 5 -0.675430827702E+03 0.16324E-03 -0.19818E-03 5440 0.105E-01 0.923E-02 DAV: 6 -0.675430785517E+03 0.42185E-04 -0.29271E-04 5280 0.342E-02 0.444E-02 DAV: 7 -0.675430752153E+03 0.33364E-04 -0.12534E-04 5184 0.223E-02 0.176E-02 DAV: 8 -0.675430748777E+03 0.33756E-05 -0.18140E-05 3904 0.118E-02 8 F= -.68739258E+03 E0= -.68739258E+03 d E =-.109305E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.675430510021E+03 0.24213E-03 -0.50367E-02 4608 0.428E-01 0.156E-01 DAV: 2 -0.675430576648E+03 -0.66627E-04 -0.15981E-03 5376 0.732E-02 0.933E-02 DAV: 3 -0.675430552528E+03 0.24120E-04 -0.57564E-05 5248 0.166E-02 0.493E-02 DAV: 4 -0.675430550907E+03 0.16204E-05 -0.29946E-05 4832 0.109E-02 9 F= -.68739288E+03 E0= -.68739288E+03 d E =-.109599E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.675564984237E+03 -0.13443E+00 -0.76356E+00 4224 0.513E+00 0.132E+00 DAV: 2 -0.675566022932E+03 -0.10387E-02 -0.19382E-01 5152 0.793E-01 0.471E-01 DAV: 3 -0.675563107758E+03 0.29152E-02 -0.79781E-03 5376 0.188E-01 0.231E-01 DAV: 4 -0.675562607906E+03 0.49985E-03 -0.24092E-03 5632 0.100E-01 0.102E-01 DAV: 5 -0.675562569621E+03 0.38285E-04 -0.33811E-04 5184 0.429E-02 0.486E-02 DAV: 6 -0.675562557328E+03 0.12293E-04 -0.56957E-05 5568 0.162E-02 0.257E-02 DAV: 7 -0.675562548366E+03 0.89619E-05 -0.85526E-06 3552 0.891E-03 10 F= -.68750554E+03 E0= -.68750554E+03 d E =-.112663E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.675835515150E+03 -0.27296E+00 -0.68760E+01 4224 0.154E+01 0.390E+00 DAV: 2 -0.675849928433E+03 -0.14413E-01 -0.17210E+00 5152 0.235E+00 0.142E+00 DAV: 3 -0.675823023443E+03 0.26905E-01 -0.75260E-02 5376 0.569E-01 0.684E-01 DAV: 4 -0.675818773616E+03 0.42498E-02 -0.20182E-02 5408 0.289E-01 0.310E-01 DAV: 5 -0.675818539219E+03 0.23440E-03 -0.31351E-03 5568 0.129E-01 0.144E-01 DAV: 6 -0.675818495820E+03 0.43399E-04 -0.44864E-04 5952 0.477E-02 0.730E-02 DAV: 7 -0.675818457639E+03 0.38181E-04 -0.89873E-05 5792 0.270E-02 0.344E-02 DAV: 8 -0.675818440796E+03 0.16843E-04 -0.34794E-05 4736 0.177E-02 0.113E-02 DAV: 9 -0.675818436022E+03 0.47743E-05 -0.91024E-06 3616 0.868E-03 11 F= -.68770161E+03 E0= -.68770161E+03 d E =-.308736E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.675867452576E+03 -0.49012E-01 -0.12492E+01 4224 0.649E+00 0.168E+00 DAV: 2 -0.675869579903E+03 -0.21273E-02 -0.31405E-01 5120 0.100E+00 0.599E-01 DAV: 3 -0.675864895539E+03 0.46844E-02 -0.12632E-02 5376 0.236E-01 0.296E-01 DAV: 4 -0.675864071118E+03 0.82442E-03 -0.40863E-03 5440 0.131E-01 0.129E-01 DAV: 5 -0.675864018222E+03 0.52896E-04 -0.57324E-04 5408 0.549E-02 0.646E-02 DAV: 6 -0.675864000511E+03 0.17711E-04 -0.92183E-05 5888 0.208E-02 0.334E-02 DAV: 7 -0.675863986603E+03 0.13908E-04 -0.15220E-05 3840 0.125E-02 0.129E-02 DAV: 8 -0.675863983150E+03 0.34532E-05 -0.77623E-06 3552 0.738E-03 12 F= -.68772090E+03 E0= -.68772090E+03 d E =-.328022E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.675968038567E+03 -0.10405E+00 -0.61297E+00 4288 0.443E+00 0.129E+00 DAV: 2 -0.675971344191E+03 -0.33056E-02 -0.15413E-01 5280 0.696E-01 0.568E-01 DAV: 3 -0.675968777410E+03 0.25668E-02 -0.70451E-03 5184 0.177E-01 0.300E-01 DAV: 4 -0.675968259134E+03 0.51828E-03 -0.20023E-03 5312 0.958E-02 0.105E-01 DAV: 5 -0.675968224197E+03 0.34937E-04 -0.31621E-04 5504 0.412E-02 0.368E-02 DAV: 6 -0.675968208153E+03 0.16043E-04 -0.58841E-05 5216 0.166E-02 0.173E-02 DAV: 7 -0.675968198807E+03 0.93460E-05 -0.10834E-05 3648 0.874E-03 13 F= -.68780666E+03 E0= -.68780666E+03 d E =-.857555E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676088012955E+03 -0.11980E+00 -0.31138E+01 4224 0.998E+00 0.286E+00 DAV: 2 -0.676106350322E+03 -0.18337E-01 -0.78819E-01 5280 0.158E+00 0.128E+00 DAV: 3 -0.676093160610E+03 0.13190E-01 -0.36541E-02 5184 0.402E-01 0.674E-01 DAV: 4 -0.676090511852E+03 0.26488E-02 -0.10140E-02 5344 0.216E-01 0.244E-01 DAV: 5 -0.676090356023E+03 0.15583E-03 -0.16046E-03 5440 0.949E-02 0.827E-02 DAV: 6 -0.676090296021E+03 0.60002E-04 -0.31858E-04 5280 0.383E-02 0.389E-02 DAV: 7 -0.676090262142E+03 0.33878E-04 -0.59533E-05 5280 0.196E-02 0.181E-02 DAV: 8 -0.676090247103E+03 0.15040E-04 -0.17334E-05 3904 0.142E-02 0.982E-03 DAV: 9 -0.676090241499E+03 0.56040E-05 -0.12240E-05 3680 0.106E-02 14 F= -.68788665E+03 E0= -.68788665E+03 d E =-.165753E+00 N E dE d eps ncg rms rms(c) DAV: 1 -0.676113036368E+03 -0.22789E-01 -0.11167E+00 4416 0.199E+00 0.452E-01 DAV: 2 -0.676113354313E+03 -0.31794E-03 -0.27782E-02 5376 0.321E-01 0.239E-01 DAV: 3 -0.676112883638E+03 0.47068E-03 -0.16474E-03 5184 0.843E-02 0.123E-01 DAV: 4 -0.676112757661E+03 0.12598E-03 -0.41955E-04 5248 0.441E-02 0.490E-02 DAV: 5 -0.676112744618E+03 0.13044E-04 -0.75270E-05 5440 0.239E-02 0.188E-02 DAV: 6 -0.676112749273E+03 -0.46557E-05 -0.30142E-05 4800 0.113E-02 15 F= -.68791799E+03 E0= -.68791799E+03 d E =-.313404E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676137924315E+03 -0.25180E-01 -0.10047E+01 4224 0.598E+00 0.135E+00 DAV: 2 -0.676140796221E+03 -0.28719E-02 -0.25146E-01 5376 0.963E-01 0.718E-01 DAV: 3 -0.676136580458E+03 0.42158E-02 -0.14349E-02 5184 0.251E-01 0.375E-01 DAV: 4 -0.676135364867E+03 0.12156E-02 -0.38048E-03 5216 0.133E-01 0.147E-01 DAV: 5 -0.676135217342E+03 0.14752E-03 -0.69881E-04 5824 0.723E-02 0.565E-02 DAV: 6 -0.676135233225E+03 -0.15883E-04 -0.25167E-04 5184 0.326E-02 0.384E-02 DAV: 7 -0.676135229623E+03 0.36017E-05 -0.28472E-05 5152 0.124E-02 16 F= -.68796685E+03 E0= -.68796685E+03 d E =-.801961E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676161638898E+03 -0.26406E-01 -0.19522E+00 4288 0.271E+00 0.957E-01 DAV: 2 -0.676157966239E+03 0.36727E-02 -0.57320E-02 5280 0.455E-01 0.305E-01 DAV: 3 -0.676156592387E+03 0.13739E-02 -0.48253E-03 5184 0.138E-01 0.153E-01 DAV: 4 -0.676156362114E+03 0.23027E-03 -0.93497E-04 5472 0.657E-02 0.744E-02 DAV: 5 -0.676156352334E+03 0.97793E-05 -0.16238E-04 5696 0.277E-02 0.334E-02 DAV: 6 -0.676156360319E+03 -0.79850E-05 -0.39084E-05 4928 0.134E-02 17 F= -.68800715E+03 E0= -.68800715E+03 d E =-.403031E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676188124957E+03 -0.31773E-01 -0.17534E+01 4224 0.813E+00 0.289E+00 DAV: 2 -0.676155050280E+03 0.33075E-01 -0.52092E-01 5280 0.137E+00 0.915E-01 DAV: 3 -0.676142871820E+03 0.12178E-01 -0.43180E-02 5184 0.415E-01 0.461E-01 DAV: 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DAV: 1 -0.676161560279E+03 -0.20121E-01 -0.16631E+01 4224 0.777E+00 0.224E+00 DAV: 2 -0.676121195064E+03 0.40365E-01 -0.48567E-01 5376 0.131E+00 0.850E-01 DAV: 3 -0.676110786787E+03 0.10408E-01 -0.37408E-02 5056 0.377E-01 0.397E-01 DAV: 4 -0.676109356821E+03 0.14300E-02 -0.69382E-03 5536 0.170E-01 0.197E-01 DAV: 5 -0.676109268112E+03 0.88708E-04 -0.96541E-04 5888 0.667E-02 0.978E-02 DAV: 6 -0.676109299202E+03 -0.31090E-04 -0.21983E-04 5568 0.317E-02 0.407E-02 DAV: 7 -0.676109310221E+03 -0.11019E-04 -0.46409E-05 5536 0.165E-02 0.206E-02 DAV: 8 -0.676109313254E+03 -0.30330E-05 -0.10206E-05 3584 0.796E-03 20 F= -.68810065E+03 E0= -.68810065E+03 d E =-.518840E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676134925221E+03 -0.25615E-01 -0.14769E+00 4352 0.234E+00 0.838E-01 DAV: 2 -0.676137405289E+03 -0.24801E-02 -0.40631E-02 5344 0.373E-01 0.262E-01 DAV: 3 -0.676136856785E+03 0.54850E-03 -0.18300E-03 5280 0.897E-02 0.143E-01 DAV: 4 -0.676136728876E+03 0.12791E-03 -0.84130E-04 5184 0.617E-02 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d eps ncg rms rms(c) DAV: 1 -0.676213437297E+03 -0.16478E-01 -0.11140E+00 4480 0.199E+00 0.484E-01 DAV: 2 -0.676215402138E+03 -0.19648E-02 -0.27085E-02 5312 0.303E-01 0.262E-01 DAV: 3 -0.676215048323E+03 0.35381E-03 -0.89547E-04 5568 0.667E-02 0.141E-01 DAV: 4 -0.676214973196E+03 0.75127E-04 -0.48449E-04 5184 0.473E-02 0.413E-02 DAV: 5 -0.676214966554E+03 0.66420E-05 -0.94855E-05 5504 0.229E-02 25 F= -.68822220E+03 E0= -.68822220E+03 d E =-.167489E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676223658325E+03 -0.86851E-02 -0.31814E+00 4224 0.336E+00 0.822E-01 DAV: 2 -0.676229270717E+03 -0.56124E-02 -0.77439E-02 5312 0.511E-01 0.441E-01 DAV: 3 -0.676228258069E+03 0.10126E-02 -0.24981E-03 5568 0.112E-01 0.239E-01 DAV: 4 -0.676228043376E+03 0.21469E-03 -0.14083E-03 5184 0.813E-02 0.693E-02 DAV: 5 -0.676228024349E+03 0.19027E-04 -0.28076E-04 5504 0.398E-02 0.279E-02 DAV: 6 -0.676228019843E+03 0.45057E-05 -0.42235E-05 5024 0.124E-02 26 F= -.68823308E+03 E0= -.68823308E+03 d E =-.276331E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676243473705E+03 -0.15449E-01 -0.68643E-01 4288 0.156E+00 0.317E-01 DAV: 2 -0.676244468990E+03 -0.99528E-03 -0.14428E-02 5184 0.224E-01 0.149E-01 DAV: 3 -0.676244295119E+03 0.17387E-03 -0.37678E-04 5472 0.443E-02 0.831E-02 DAV: 4 -0.676244251233E+03 0.43886E-04 -0.27693E-04 5184 0.349E-02 0.239E-02 DAV: 5 -0.676244248643E+03 0.25901E-05 -0.39268E-05 4992 0.142E-02 27 F= -.68824684E+03 E0= -.68824684E+03 d E =-.137563E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676273499686E+03 -0.29248E-01 -0.61584E+00 4224 0.468E+00 0.960E-01 DAV: 2 -0.676282385545E+03 -0.88859E-02 -0.12835E-01 5216 0.666E-01 0.449E-01 DAV: 3 -0.676280812532E+03 0.15730E-02 -0.33876E-03 5504 0.133E-01 0.247E-01 DAV: 4 -0.676280454242E+03 0.35829E-03 -0.24435E-03 5184 0.103E-01 0.709E-02 DAV: 5 -0.676280445811E+03 0.84306E-05 -0.34398E-04 5376 0.416E-02 0.432E-02 DAV: 6 -0.676280443878E+03 0.19337E-05 -0.82775E-05 4992 0.173E-02 28 F= -.68827560E+03 E0= -.68827560E+03 d E =-.425117E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676268045382E+03 0.12400E-01 -0.24599E+01 4224 0.935E+00 0.194E+00 DAV: 2 -0.676303317195E+03 -0.35272E-01 -0.50852E-01 5216 0.133E+00 0.902E-01 DAV: 3 -0.676296949694E+03 0.63675E-02 -0.14021E-02 5504 0.270E-01 0.494E-01 DAV: 4 -0.676295517252E+03 0.14324E-02 -0.95342E-03 5184 0.204E-01 0.141E-01 DAV: 5 -0.676295500270E+03 0.16982E-04 -0.13495E-03 5440 0.824E-02 0.846E-02 DAV: 6 -0.676295499867E+03 0.40328E-06 -0.31172E-04 4992 0.339E-02 0.478E-02 DAV: 7 -0.676295481261E+03 0.18605E-04 -0.51183E-05 5024 0.201E-02 0.255E-02 DAV: 8 -0.676295476899E+03 0.43622E-05 -0.21020E-05 4832 0.103E-02 29 F= -.68827562E+03 E0= -.68827562E+03 d E =-.425387E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676290542070E+03 0.49392E-02 -0.62681E+00 4224 0.472E+00 0.970E-01 DAV: 2 -0.676299522104E+03 -0.89800E-02 -0.13209E-01 5184 0.675E-01 0.463E-01 DAV: 3 -0.676297923291E+03 0.15988E-02 -0.34700E-03 5504 0.135E-01 0.270E-01 DAV: 4 -0.676297540944E+03 0.38235E-03 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DAV: 5 -0.676377086953E+03 -0.23720E-05 -0.19531E-04 5568 0.330E-02 0.300E-02 DAV: 6 -0.676377089080E+03 -0.21278E-05 -0.58075E-05 5152 0.157E-02 35 F= -.68836982E+03 E0= -.68836982E+03 d E =-.238139E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676363956500E+03 0.13130E-01 -0.80174E+00 4224 0.521E+00 0.137E+00 DAV: 2 -0.676373032364E+03 -0.90759E-02 -0.16905E-01 5184 0.762E-01 0.595E-01 DAV: 3 -0.676370505137E+03 0.25272E-02 -0.72246E-03 5408 0.182E-01 0.314E-01 DAV: 4 -0.676369996899E+03 0.50824E-03 -0.30417E-03 5184 0.123E-01 0.948E-02 DAV: 5 -0.676369997030E+03 -0.13169E-06 -0.44553E-04 5536 0.499E-02 0.458E-02 DAV: 6 -0.676369998035E+03 -0.10046E-05 -0.13287E-04 5216 0.237E-02 0.298E-02 DAV: 7 -0.676369994891E+03 0.31441E-05 -0.13267E-05 3616 0.105E-02 36 F= -.68838102E+03 E0= -.68838102E+03 d E =-.350125E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676367011299E+03 0.29867E-02 -0.49486E+00 4224 0.400E+00 0.889E-01 DAV: 2 -0.676371511274E+03 -0.45000E-02 -0.10469E-01 5280 0.602E-01 0.425E-01 DAV: 3 -0.676370113838E+03 0.13974E-02 -0.51938E-03 5216 0.148E-01 0.210E-01 DAV: 4 -0.676369884788E+03 0.22905E-03 -0.13630E-03 5312 0.798E-02 0.796E-02 DAV: 5 -0.676369888852E+03 -0.40641E-05 -0.20456E-04 5408 0.357E-02 0.298E-02 DAV: 6 -0.676369898723E+03 -0.98705E-05 -0.47483E-05 5152 0.135E-02 37 F= -.68839601E+03 E0= -.68839601E+03 d E =-.149912E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676366512372E+03 0.33765E-02 -0.32342E-01 4416 0.102E+00 0.227E-01 DAV: 2 -0.676366826722E+03 -0.31435E-03 -0.68563E-03 5280 0.153E-01 0.108E-01 DAV: 3 -0.676366736515E+03 0.90208E-04 -0.34298E-04 5216 0.381E-02 0.539E-02 DAV: 4 -0.676366723757E+03 0.12757E-04 -0.86966E-05 5312 0.202E-02 0.209E-02 DAV: 5 -0.676366725512E+03 -0.17551E-05 -0.11213E-05 3456 0.930E-03 38 F= -.68839668E+03 E0= -.68839668E+03 d E =-.156597E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676371623353E+03 -0.48996E-02 -0.20897E+00 4224 0.262E+00 0.581E-01 DAV: 2 -0.676374746422E+03 -0.31231E-02 -0.47340E-02 5344 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E0= -.68938183E+03 d E =-.450656E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.676987130068E+03 -0.24556E-02 -0.43952E-01 4288 0.123E+00 0.220E-01 DAV: 2 -0.676988014737E+03 -0.88467E-03 -0.10576E-02 4992 0.186E-01 0.986E-02 DAV: 3 -0.676987950768E+03 0.63969E-04 -0.19880E-04 5568 0.319E-02 0.584E-02 DAV: 4 -0.676987934295E+03 0.16473E-04 -0.13759E-04 5216 0.251E-02 0.184E-02 DAV: 5 -0.676987933301E+03 0.99407E-06 -0.21241E-05 4352 0.107E-02 157 F= -.68938334E+03 E0= -.68938334E+03 d E =-.150112E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.676989437160E+03 -0.15029E-02 -0.18641E+00 4224 0.253E+00 0.448E-01 DAV: 2 -0.676993137382E+03 -0.37002E-02 -0.44449E-02 4992 0.382E-01 0.204E-01 DAV: 3 -0.676992849828E+03 0.28755E-03 -0.84184E-04 5568 0.660E-02 0.121E-01 DAV: 4 -0.676992776730E+03 0.73098E-04 -0.59264E-04 5216 0.518E-02 0.378E-02 DAV: 5 -0.676992776325E+03 0.40510E-06 -0.96666E-05 5216 0.224E-02 158 F= -.68938452E+03 E0= -.68938452E+03 d E =-.268885E-02 N E dE d eps ncg rms rms(c) DAV: 1 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DAV: 4 -0.677001885011E+03 0.16023E-04 -0.74174E-05 5216 0.197E-02 0.141E-02 DAV: 5 -0.677001883905E+03 0.11062E-05 -0.11847E-05 3648 0.913E-03 177 F= -.68939863E+03 E0= -.68939863E+03 d E =-.106290E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.677002462968E+03 -0.57796E-03 -0.63650E-02 4224 0.471E-01 0.722E-02 DAV: 2 -0.677002583992E+03 -0.12102E-03 -0.13639E-03 5120 0.686E-02 0.349E-02 DAV: 3 -0.677002574959E+03 0.90332E-05 -0.22708E-05 4608 0.106E-02 178 F= -.68939913E+03 E0= -.68939913E+03 d E =-.496235E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.677003203869E+03 -0.61988E-03 -0.56853E-01 4224 0.141E+00 0.215E-01 DAV: 2 -0.677004240495E+03 -0.10366E-02 -0.11839E-02 5120 0.203E-01 0.106E-01 DAV: 3 -0.677004162282E+03 0.78213E-04 -0.22731E-04 5536 0.323E-02 0.633E-02 DAV: 4 -0.677004138716E+03 0.23566E-04 -0.16609E-04 5248 0.293E-02 0.160E-02 DAV: 5 -0.677004139383E+03 -0.66697E-06 -0.30028E-05 4704 0.125E-02 179 F= -.68940010E+03 E0= -.68940010E+03 d E =-.146998E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.677001079438E+03 0.30593E-02 -0.22893E+00 4224 0.282E+00 0.430E-01 DAV: 2 -0.677005371948E+03 -0.42925E-02 -0.48616E-02 5120 0.411E-01 0.210E-01 DAV: 3 -0.677005049216E+03 0.32273E-03 -0.88013E-04 5536 0.642E-02 0.127E-01 DAV: 4 -0.677004951580E+03 0.97636E-04 -0.69007E-04 5248 0.591E-02 0.314E-02 DAV: 5 -0.677004955869E+03 -0.42883E-05 -0.12609E-04 5216 0.251E-02 0.198E-02 DAV: 6 -0.677004954305E+03 0.15636E-05 -0.22788E-05 4448 0.962E-03 180 F= -.68939971E+03 E0= -.68939971E+03 d E =-.107546E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.677003285146E+03 0.16707E-02 -0.90827E-01 4224 0.178E+00 0.267E-01 DAV: 2 -0.677004965128E+03 -0.16800E-02 -0.19161E-02 5120 0.258E-01 0.134E-01 DAV: 3 -0.677004833713E+03 0.13141E-03 -0.34964E-04 5536 0.403E-02 0.810E-02 DAV: 4 -0.677004795989E+03 0.37724E-04 -0.27967E-04 5248 0.372E-02 0.200E-02 DAV: 5 -0.677004799284E+03 -0.32944E-05 -0.48629E-05 4992 0.155E-02 181 F= -.68940032E+03 E0= -.68940032E+03 d E =-.168714E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.677005232281E+03 -0.43629E-03 -0.55953E-02 4288 0.442E-01 0.814E-02 DAV: 2 -0.677005332628E+03 -0.10035E-03 -0.12002E-03 5312 0.649E-02 0.393E-02 DAV: 3 -0.677005322823E+03 0.98053E-05 -0.26534E-05 4800 0.111E-02 182 F= -.68940086E+03 E0= -.68940086E+03 d E =-.544246E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.677005184428E+03 0.14820E-03 -0.50127E-01 4224 0.132E+00 0.248E-01 DAV: 2 -0.677006096634E+03 -0.91221E-03 -0.10835E-02 5280 0.195E-01 0.118E-01 DAV: 3 -0.677006023500E+03 0.73134E-04 -0.23974E-04 5472 0.335E-02 0.670E-02 DAV: 4 -0.677006004728E+03 0.18772E-04 -0.13413E-04 5248 0.265E-02 0.164E-02 DAV: 5 -0.677006004835E+03 -0.10703E-06 -0.24870E-05 4832 0.121E-02 183 F= -.68940160E+03 E0= -.68940160E+03 d E =-.128460E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.677006000578E+03 0.41494E-05 -0.29243E-02 4416 0.320E-01 0.612E-02 DAV: 2 -0.677006052778E+03 -0.52200E-04 -0.64772E-04 5280 0.472E-02 0.347E-02 DAV: 3 -0.677006047436E+03 0.53423E-05 -0.11526E-05 3712 0.811E-03 184 F= -.68940198E+03 E0= -.68940198E+03 d E =-.376755E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.677005295516E+03 0.75726E-03 -0.26130E-01 4224 0.955E-01 0.184E-01 DAV: 2 -0.677005740808E+03 -0.44529E-03 -0.55775E-03 5280 0.139E-01 0.107E-01 DAV: 3 -0.677005694053E+03 0.46755E-04 -0.11824E-04 5568 0.239E-02 0.622E-02 DAV: 4 -0.677005683638E+03 0.10415E-04 -0.89289E-05 5184 0.197E-02 0.146E-02 DAV: 5 -0.677005685232E+03 -0.15947E-05 -0.14181E-05 3840 0.866E-03 185 F= -.68940262E+03 E0= -.68940262E+03 d E =-.101558E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.677005079901E+03 0.60374E-03 -0.57359E-02 4288 0.454E-01 0.918E-02 DAV: 2 -0.677005170375E+03 -0.90474E-04 -0.12736E-03 5248 0.665E-02 0.358E-02 DAV: 3 -0.677005159573E+03 0.10802E-04 -0.31464E-05 4864 0.121E-02 0.184E-02 DAV: 4 -0.677005158364E+03 0.12089E-05 -0.11584E-05 3328 0.756E-03 186 F= -.68940319E+03 E0= -.68940319E+03 d E =-.575981E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.677002496567E+03 0.26630E-02 -0.37194E-01 4224 0.116E+00 0.234E-01 DAV: 2 -0.677003069203E+03 -0.57264E-03 -0.81870E-03 5248 0.169E-01 0.930E-02 DAV: 3 -0.677002997334E+03 0.71869E-04 -0.21622E-04 5408 0.315E-02 0.475E-02 DAV: 4 -0.677002986533E+03 0.10802E-04 -0.83037E-05 5280 0.193E-02 0.151E-02 DAV: 5 -0.677002989359E+03 -0.28260E-05 -0.10216E-05 3552 0.841E-03 187 F= -.68940383E+03 E0= -.68940383E+03 d E =-.121346E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.677002023153E+03 0.96338E-03 -0.52522E-02 4288 0.436E-01 0.878E-02 DAV: 2 -0.677002092981E+03 -0.69828E-04 -0.11416E-03 5216 0.628E-02 0.385E-02 DAV: 3 -0.677002082633E+03 0.10349E-04 -0.35317E-05 4960 0.128E-02 0.210E-02 DAV: 4 -0.677002081896E+03 0.73670E-06 -0.10186E-05 3328 0.726E-03 188 F= -.68940421E+03 E0= -.68940421E+03 d E =-.378418E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.676998888885E+03 0.31937E-02 -0.33352E-01 4288 0.110E+00 0.223E-01 DAV: 2 -0.676999315672E+03 -0.42679E-03 -0.72154E-03 5216 0.158E-01 0.985E-02 DAV: 3 -0.676999247425E+03 0.68248E-04 -0.24129E-04 5408 0.332E-02 0.535E-02 DAV: 4 -0.676999237886E+03 0.95388E-05 -0.72083E-05 5568 0.184E-02 189 F= -.68940461E+03 E0= -.68940461E+03 d E =-.776260E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.676998998568E+03 0.24886E-03 -0.19998E-02 4352 0.262E-01 0.587E-02 DAV: 2 -0.676999034735E+03 -0.36167E-04 -0.46628E-04 5312 0.394E-02 0.276E-02 DAV: 3 -0.676999031299E+03 0.34364E-05 -0.10565E-05 3584 0.761E-03 190 F= -.68940489E+03 E0= -.68940489E+03 d E =-.278361E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.676997607831E+03 0.14269E-02 -0.17895E-01 4288 0.783E-01 0.174E-01 DAV: 2 -0.676997914359E+03 -0.30653E-03 -0.40878E-03 5312 0.116E-01 0.830E-02 DAV: 3 -0.676997878463E+03 0.35896E-04 -0.10337E-04 5536 0.220E-02 0.478E-02 DAV: 4 -0.676997871083E+03 0.73793E-05 -0.64614E-05 5216 0.172E-02 191 F= -.68940518E+03 E0= -.68940518E+03 d E =-.572761E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.676997869121E+03 0.93415E-05 -0.84433E-03 4608 0.171E-01 0.316E-02 DAV: 2 -0.676997883994E+03 -0.14873E-04 -0.18739E-04 5280 0.256E-02 0.163E-02 DAV: 3 -0.676997883106E+03 0.88730E-06 -0.39515E-06 3104 0.471E-03 192 F= -.68940536E+03 E0= -.68940536E+03 d E =-.174120E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.676997662850E+03 0.22114E-03 -0.74959E-02 4288 0.510E-01 0.819E-02 DAV: 2 -0.676997789423E+03 -0.12657E-03 -0.15686E-03 5376 0.735E-02 0.439E-02 DAV: 3 -0.676997779763E+03 0.96600E-05 -0.34512E-05 5120 0.126E-02 193 F= -.68940574E+03 E0= -.68940574E+03 d E =-.556923E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.676996537613E+03 0.12518E-02 -0.29949E-01 4224 0.102E+00 0.165E-01 DAV: 2 -0.676997034776E+03 -0.49716E-03 -0.61968E-03 5312 0.147E-01 0.898E-02 DAV: 3 -0.676996996140E+03 0.38635E-04 -0.14376E-04 5408 0.256E-02 0.542E-02 DAV: 4 -0.676996986773E+03 0.93671E-05 -0.94180E-05 5248 0.202E-02 194 F= -.68940592E+03 E0= -.68940592E+03 d E =-.735421E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.676997291178E+03 -0.29504E-03 -0.34413E-02 4288 0.346E-01 0.502E-02 DAV: 2 -0.676997351906E+03 -0.60728E-04 -0.72130E-04 5248 0.496E-02 0.291E-02 DAV: 3 -0.676997346660E+03 0.52460E-05 -0.12925E-05 3744 0.811E-03 195 F= -.68940595E+03 E0= -.68940595E+03 d E =-.767120E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.676997760050E+03 -0.40814E-03 -0.18633E-02 4288 0.259E-01 0.614E-02 DAV: 2 -0.676997798387E+03 -0.38337E-04 -0.49040E-04 5376 0.413E-02 0.400E-02 DAV: 3 -0.676997794261E+03 0.41256E-05 -0.15405E-05 4288 0.861E-03 196 F= -.68940626E+03 E0= -.68940626E+03 d E =-.315461E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.676998181609E+03 -0.38322E-03 -0.67356E-02 4288 0.492E-01 0.119E-01 DAV: 2 -0.676998306000E+03 -0.12439E-03 -0.16591E-03 5376 0.764E-02 0.777E-02 DAV: 3 -0.676998291784E+03 0.14216E-04 -0.62234E-05 5120 0.168E-02 0.429E-02 DAV: 4 -0.676998288517E+03 0.32676E-05 -0.24670E-05 4768 0.110E-02 197 F= -.68940650E+03 E0= -.68940650E+03 d E =-.555408E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.676998552478E+03 -0.26069E-03 -0.23651E-02 4288 0.294E-01 0.830E-02 DAV: 2 -0.676998600946E+03 -0.48468E-04 -0.59486E-04 5280 0.450E-02 0.330E-02 DAV: 3 -0.676998596115E+03 0.48310E-05 -0.14719E-05 3904 0.859E-03 198 F= -.68940676E+03 E0= -.68940676E+03 d E =-.259789E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.676998661610E+03 -0.60664E-04 -0.15639E-01 4288 0.756E-01 0.213E-01 DAV: 2 -0.676998968554E+03 -0.30694E-03 -0.38350E-03 5312 0.115E-01 0.861E-02 DAV: 3 -0.676998935402E+03 0.33152E-04 -0.11079E-04 5408 0.222E-02 0.464E-02 DAV: 4 -0.676998929172E+03 0.62299E-05 -0.61609E-05 5216 0.167E-02 199 F= -.68940697E+03 E0= -.68940697E+03 d E =-.467717E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.676998890877E+03 0.44525E-04 -0.10014E-02 4352 0.192E-01 0.486E-02 DAV: 2 -0.676998909585E+03 -0.18708E-04 -0.24340E-04 5248 0.289E-02 0.205E-02 DAV: 3 -0.676998906921E+03 0.26641E-05 -0.53112E-06 3200 0.522E-03 200 F= -.68940698E+03 E0= -.68940698E+03 d E =-.477407E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.676999690070E+03 -0.78049E-03 -0.20346E-02 4288 0.273E-01 0.595E-02 DAV: 2 -0.676999725054E+03 -0.34983E-04 -0.51137E-04 5376 0.428E-02 0.303E-02 DAV: 3 -0.676999720934E+03 0.41195E-05 -0.17329E-05 4352 0.909E-03 201 F= -.68940723E+03 E0= -.68940723E+03 d E =-.252239E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.677001046965E+03 -0.13219E-02 -0.96162E-02 4288 0.592E-01 0.133E-01 DAV: 2 -0.677001194203E+03 -0.14724E-03 -0.23162E-03 5376 0.918E-02 0.661E-02 DAV: 3 -0.677001176243E+03 0.17959E-04 -0.96249E-05 5408 0.207E-02 0.360E-02 DAV: 4 -0.677001171164E+03 0.50793E-05 -0.30457E-05 4960 0.127E-02 202 F= -.68940745E+03 E0= -.68940745E+03 d E =-.470251E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.677002510534E+03 -0.13343E-02 -0.26096E-02 4288 0.302E-01 0.769E-02 DAV: 2 -0.677002552962E+03 -0.42427E-04 -0.64555E-04 5184 0.474E-02 0.392E-02 DAV: 3 -0.677002547319E+03 0.56422E-05 -0.17829E-05 3680 0.976E-03 203 F= -.68940766E+03 E0= -.68940766E+03 d E =-.212412E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.677005028779E+03 -0.24758E-02 -0.11823E-01 4288 0.643E-01 0.163E-01 DAV: 2 -0.677005216873E+03 -0.18809E-03 -0.28565E-03 5184 0.997E-02 0.845E-02 DAV: 3 -0.677005192193E+03 0.24680E-04 -0.93671E-05 5536 0.202E-02 0.432E-02 DAV: 4 -0.677005188636E+03 0.35566E-05 -0.35897E-05 5280 0.126E-02 204 F= -.68940782E+03 E0= -.68940782E+03 d E =-.366499E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.677004598434E+03 0.59376E-03 -0.63910E-03 4544 0.150E-01 0.379E-02 DAV: 2 -0.677004606924E+03 -0.84904E-05 -0.15441E-04 5184 0.232E-02 0.199E-02 DAV: 3 -0.677004604283E+03 0.26415E-05 -0.48980E-06 2912 0.485E-03 205 F= -.68940781E+03 E0= -.68940781E+03 d E =-.361569E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.677005073057E+03 -0.46613E-03 -0.20819E-02 4288 0.271E-01 0.514E-02 DAV: 2 -0.677005115880E+03 -0.42823E-04 -0.48265E-04 5120 0.406E-02 0.215E-02 DAV: 3 -0.677005113379E+03 0.25011E-05 -0.79629E-06 3680 0.667E-03 206 F= -.68940804E+03 E0= -.68940804E+03 d E =-.226867E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.677006050772E+03 -0.93489E-03 -0.18479E-01 4224 0.806E-01 0.155E-01 DAV: 2 -0.677006411135E+03 -0.36036E-03 -0.41344E-03 5120 0.119E-01 0.639E-02 DAV: 3 -0.677006390819E+03 0.20316E-04 -0.83315E-05 5536 0.198E-02 0.376E-02 DAV: 4 -0.677006386971E+03 0.38479E-05 -0.53317E-05 5184 0.161E-02 207 F= -.68940847E+03 E0= -.68940847E+03 d E =-.652022E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.677006725079E+03 -0.33426E-03 -0.27093E-02 4352 0.308E-01 0.630E-02 DAV: 2 -0.677006779338E+03 -0.54259E-04 -0.62624E-04 5120 0.462E-02 0.252E-02 DAV: 3 -0.677006776813E+03 0.25250E-05 -0.11507E-05 3744 0.800E-03 208 F= -.68940853E+03 E0= -.68940853E+03 d E =-.718613E-03 N E dE d eps ncg rms rms(c) DAV: 1 -0.677006683379E+03 0.95959E-04 -0.55371E-02 4288 0.440E-01 0.927E-02 DAV: 2 -0.677006797636E+03 -0.11426E-03 -0.12753E-03 5248 0.667E-02 0.526E-02 DAV: 3 -0.677006790650E+03 0.69860E-05 -0.27023E-05 4800 0.115E-02 209 F= -.68940887E+03 E0= -.68940887E+03 d E =-.340791E-03