N E dE d eps ncg rms rms(c)
DAV: 1 0.247704554464E+04 0.24770E+04 -0.17643E+05 3864 0.123E+03
DAV: 2 -0.414315836967E+03 -0.28914E+04 -0.28346E+04 4524 0.327E+02
DAV: 3 -0.641536368688E+03 -0.22722E+03 -0.22613E+03 4352 0.100E+02
DAV: 4 -0.646197661417E+03 -0.46613E+01 -0.46450E+01 4600 0.148E+01
DAV: 5 -0.646313652494E+03 -0.11599E+00 -0.11582E+00 4416 0.219E+00 0.705E+01
DAV: 6 -0.570501796104E+03 0.75812E+02 -0.32514E+02 4224 0.353E+01 0.338E+01
DAV: 7 -0.570052349202E+03 0.44945E+00 -0.10752E+01 4704 0.661E+00 0.127E+01
DAV: 8 -0.569848626627E+03 0.20372E+00 -0.82304E-01 4440 0.262E+00 0.525E+00
DAV: 9 -0.569876982576E+03 -0.28356E-01 -0.31040E-01 4464 0.154E+00 0.924E-01
DAV: 10 -0.569883711854E+03 -0.67293E-02 -0.42627E-02 4384 0.588E-01 0.547E-01
DAV: 11 -0.569885152000E+03 -0.14401E-02 -0.72408E-03 4384 0.241E-01 0.285E-01
DAV: 12 -0.569885285240E+03 -0.13324E-03 -0.28868E-03 4304 0.178E-01 0.987E-02
DAV: 13 -0.569885012017E+03 0.27322E-03 -0.10130E-03 4448 0.141E-01 0.766E-02
DAV: 14 -0.569885011454E+03 0.56369E-06 -0.70660E-04 4416 0.785E-02 0.542E-02
DAV: 15 -0.569884989840E+03 0.21613E-04 -0.77153E-05 4200 0.246E-02 0.305E-02
DAV: 16 -0.569884977648E+03 0.12192E-04 -0.83191E-05 3872 0.308E-02 0.127E-02
DAV: 17 -0.569884977866E+03 -0.21773E-06 -0.26480E-05 3240 0.202E-02
1 F= -.56988498E+03 E0= -.56988893E+03 d E =-.569885E+03
N E dE d eps ncg rms rms(c)
DAV: 1 -0.492760824644E+03 0.77124E+02 -0.56774E+03 4080 0.143E+02 0.703E+01
DAV: 2 -0.529114037158E+03 -0.36353E+02 -0.52690E+02 4356 0.407E+01 0.335E+01
DAV: 3 -0.523208786923E+03 0.59053E+01 -0.67417E+01 4288 0.209E+01 0.154E+01
DAV: 4 -0.522774439038E+03 0.43435E+00 -0.23710E+01 4312 0.899E+00 0.947E+00
DAV: 5 -0.522281779033E+03 0.49266E+00 -0.24687E+00 4512 0.520E+00 0.568E+00
DAV: 6 -0.522360123511E+03 -0.78344E-01 -0.17073E+00 4312 0.263E+00 0.335E+00
DAV: 7 -0.522281561021E+03 0.78562E-01 -0.11773E+00 5296 0.166E+00 0.179E+00
DAV: 8 -0.522261002563E+03 0.20558E-01 -0.33127E-01 4264 0.132E+00 0.512E-01
DAV: 9 -0.522261874434E+03 -0.87187E-03 -0.63804E-02 4360 0.514E-01 0.839E-01
DAV: 10 -0.522260383040E+03 0.14914E-02 -0.93180E-03 4288 0.256E-01 0.388E-01
DAV: 11 -0.522260112140E+03 0.27090E-03 -0.55727E-03 4368 0.158E-01 0.208E-01
DAV: 12 -0.522260027901E+03 0.84239E-04 -0.22008E-03 4944 0.104E-01 0.944E-02
DAV: 13 -0.522259774707E+03 0.25319E-03 -0.96019E-04 4608 0.656E-02 0.588E-02
DAV: 14 -0.522259716515E+03 0.58191E-04 -0.17816E-04 4400 0.441E-02 0.243E-02
DAV: 15 -0.522259695587E+03 0.20928E-04 -0.69127E-05 4072 0.409E-02 0.248E-02
DAV: 16 -0.522259694852E+03 0.73554E-06 -0.56196E-05 4248 0.217E-02
2 F= -.52225969E+03 E0= -.52227288E+03 d E =0.476253E+02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.532631615742E+03 -0.10372E+02 -0.41934E+03 4016 0.141E+02 0.608E+01
DAV: 2 -0.579589488213E+03 -0.46958E+02 -0.55093E+02 4372 0.435E+01 0.240E+01
DAV: 3 -0.576978579179E+03 0.26109E+01 -0.44706E+01 4360 0.105E+01 0.258E+01
DAV: 4 -0.576497597606E+03 0.48098E+00 -0.35546E+00 4288 0.365E+00 0.248E+01
DAV: 5 -0.577043744116E+03 -0.54615E+00 -0.12476E+00 4296 0.320E+00 0.187E+01
DAV: 6 -0.576404155193E+03 0.63959E+00 -0.96835E-01 4352 0.250E+00 0.989E+00
DAV: 7 -0.575634907990E+03 0.76925E+00 -0.19616E+00 4304 0.354E+00 0.612E+00
DAV: 8 -0.575642130236E+03 -0.72222E-02 -0.21080E-01 4184 0.945E-01 0.514E+00
DAV: 9 -0.575576548510E+03 0.65582E-01 -0.66153E-02 4400 0.660E-01 0.429E+00
DAV: 10 -0.575516932260E+03 0.59616E-01 -0.22970E-01 4280 0.122E+00 0.122E+00
DAV: 11 -0.575514955404E+03 0.19769E-02 -0.30915E-02 4344 0.420E-01 0.657E-01
DAV: 12 -0.575514158394E+03 0.79701E-03 -0.27019E-03 4304 0.120E-01 0.467E-01
DAV: 13 -0.575513477604E+03 0.68079E-03 -0.91250E-04 4360 0.796E-02 0.274E-01
DAV: 14 -0.575512968456E+03 0.50915E-03 -0.34391E-03 4328 0.167E-01 0.152E-01
DAV: 15 -0.575513020648E+03 -0.52192E-04 -0.71691E-04 4400 0.746E-02 0.162E-01
DAV: 16 -0.575513020563E+03 0.85041E-07 -0.50490E-05 3680 0.185E-02
3 F= -.57551302E+03 E0= -.57551689E+03 d E =-.562804E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.575538966240E+03 -0.25946E-01 -0.29804E+00 3840 0.350E+00 0.102E+00
DAV: 2 -0.575542284039E+03 -0.33178E-02 -0.74956E-02 4360 0.484E-01 0.240E-01
DAV: 3 -0.575540798667E+03 0.14854E-02 -0.31541E-03 4416 0.142E-01 0.127E-01
DAV: 4 -0.575540550038E+03 0.24863E-03 -0.23425E-03 4360 0.119E-01 0.489E-02
DAV: 5 -0.575540564147E+03 -0.14109E-04 -0.38580E-04 4288 0.432E-02 0.510E-02
DAV: 6 -0.575540560424E+03 0.37236E-05 -0.69966E-05 4080 0.209E-02
4 F= -.57554056E+03 E0= -.57554443E+03 d E =-.565558E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.573173830093E+03 0.23667E+01 -0.76120E+02 3956 0.589E+01 0.971E+00
DAV: 2 -0.576338680501E+03 -0.31649E+01 -0.37133E+01 4424 0.110E+01 0.609E+00
DAV: 3 -0.576003064841E+03 0.33562E+00 -0.76733E-01 4368 0.209E+00 0.401E+00
DAV: 4 -0.575822518217E+03 0.18055E+00 -0.85625E-01 4312 0.237E+00 0.119E+00
DAV: 5 -0.575809978022E+03 0.12540E-01 -0.17278E-01 4488 0.111E+00 0.769E-01
DAV: 6 -0.575806502482E+03 0.34755E-02 -0.60713E-02 4360 0.607E-01 0.374E-01
DAV: 7 -0.575804277895E+03 0.22246E-02 -0.62653E-03 5360 0.305E-01 0.195E-01
DAV: 8 -0.575803200262E+03 0.10776E-02 -0.34302E-03 4440 0.218E-01 0.874E-02
DAV: 9 -0.575802788222E+03 0.41204E-03 -0.10883E-03 4768 0.134E-01 0.645E-02
DAV: 10 -0.575802662018E+03 0.12620E-03 -0.55924E-04 4416 0.840E-02 0.381E-02
DAV: 11 -0.575802588032E+03 0.73985E-04 -0.10878E-04 4360 0.618E-02 0.228E-02
DAV: 12 -0.575802581319E+03 0.67132E-05 -0.12415E-04 4496 0.361E-02 0.156E-02
DAV: 13 -0.575802581417E+03 -0.97614E-07 -0.21678E-05 3120 0.114E-02
5 F= -.57580258E+03 E0= -.57580645E+03 d E =-.262021E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.577407067826E+03 -0.16045E+01 -0.22622E+02 3776 0.283E+01 0.627E+00
DAV: 2 -0.578026709025E+03 -0.61964E+00 -0.76321E+00 4328 0.552E+00 0.284E+00
DAV: 3 -0.577938529634E+03 0.88179E-01 -0.19986E-01 4440 0.124E+00 0.170E+00
DAV: 4 -0.577902161825E+03 0.36368E-01 -0.23344E-01 4280 0.118E+00 0.575E-01
DAV: 5 -0.577895075896E+03 0.70859E-02 -0.33815E-02 5368 0.650E-01 0.327E-01
DAV: 6 -0.577893817332E+03 0.12586E-02 -0.12562E-02 4544 0.369E-01 0.161E-01
DAV: 7 -0.577893462446E+03 0.35489E-03 -0.24867E-03 4424 0.166E-01 0.982E-02
DAV: 8 -0.577893120683E+03 0.34176E-03 -0.71833E-04 4424 0.110E-01 0.436E-02
DAV: 9 -0.577892963542E+03 0.15714E-03 -0.36428E-04 4736 0.951E-02 0.242E-02
DAV: 10 -0.577892953712E+03 0.98302E-05 -0.34580E-04 4432 0.617E-02 0.352E-02
DAV: 11 -0.577892946021E+03 0.76905E-05 -0.51178E-05 4184 0.212E-02
6 F= -.57789295E+03 E0= -.57789682E+03 d E =-.235239E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.578440824862E+03 -0.54787E+00 -0.36550E+02 3776 0.442E+01 0.694E+00
DAV: 2 -0.579154661951E+03 -0.71384E+00 -0.97102E+00 4336 0.664E+00 0.245E+00
DAV: 3 -0.579013323015E+03 0.14134E+00 -0.26778E-01 4440 0.161E+00 0.141E+00
DAV: 4 -0.578962819014E+03 0.50504E-01 -0.26986E-01 4336 0.163E+00 0.535E-01
DAV: 5 -0.578960000080E+03 0.28189E-02 -0.73397E-02 4424 0.732E-01 0.655E-01
DAV: 6 -0.578958059634E+03 0.19404E-02 -0.12798E-02 4408 0.274E-01 0.492E-01
DAV: 7 -0.578958920823E+03 -0.86119E-03 -0.10778E-02 5408 0.250E-01 0.470E-01
DAV: 8 -0.578956431568E+03 0.24893E-02 -0.31006E-03 4400 0.167E-01 0.272E-01
DAV: 9 -0.578955450937E+03 0.98063E-03 -0.29015E-03 5168 0.155E-01 0.800E-02
DAV: 10 -0.578955538189E+03 -0.87252E-04 -0.96147E-04 4576 0.900E-02 0.930E-02
DAV: 11 -0.578955398128E+03 0.14006E-03 -0.57177E-04 4856 0.629E-02 0.299E-02
DAV: 12 -0.578955394862E+03 0.32656E-05 -0.97431E-05 4400 0.288E-02
7 F= -.57895539E+03 E0= -.57896346E+03 d E =-.106245E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.578984337254E+03 -0.28939E-01 -0.89055E+00 3776 0.698E+00 0.115E+00
DAV: 2 -0.578998228786E+03 -0.13892E-01 -0.21894E-01 4360 0.105E+00 0.449E-01
DAV: 3 -0.578995594047E+03 0.26347E-02 -0.13575E-02 4600 0.336E-01 0.280E-01
DAV: 4 -0.578993893763E+03 0.17003E-02 -0.44824E-03 4488 0.197E-01 0.139E-01
DAV: 5 -0.578993651517E+03 0.24225E-03 -0.23642E-03 4424 0.144E-01 0.110E-01
DAV: 6 -0.578993598111E+03 0.53406E-04 -0.13049E-03 5032 0.913E-02 0.696E-02
DAV: 7 -0.578993520024E+03 0.78087E-04 -0.24122E-04 4640 0.476E-02 0.247E-02
DAV: 8 -0.578993517485E+03 0.25383E-05 -0.28349E-05 3432 0.175E-02
8 F= -.57899352E+03 E0= -.57900187E+03 d E =-.110057E+01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.579378640021E+03 -0.38512E+00 -0.26539E+02 3776 0.384E+01 0.516E+00
DAV: 2 -0.579879033550E+03 -0.50039E+00 -0.67221E+00 4384 0.567E+00 0.213E+00
DAV: 3 -0.579799558718E+03 0.79475E-01 -0.19723E-01 4432 0.127E+00 0.127E+00
DAV: 4 -0.579765679314E+03 0.33879E-01 -0.12830E-01 4384 0.103E+00 0.415E-01
DAV: 5 -0.579764937322E+03 0.74199E-03 -0.27814E-02 4472 0.490E-01 0.318E-01
DAV: 6 -0.579764086712E+03 0.85061E-03 -0.78360E-03 4392 0.260E-01 0.183E-01
DAV: 7 -0.579763283691E+03 0.80302E-03 -0.99660E-04 4696 0.142E-01 0.107E-01
DAV: 8 -0.579762325930E+03 0.95776E-03 -0.99861E-04 5712 0.172E-01 0.786E-02
DAV: 9 -0.579762515182E+03 -0.18925E-03 -0.64044E-04 4296 0.580E-02 0.840E-02
DAV: 10 -0.579762518004E+03 -0.28219E-05 -0.32951E-05 3600 0.154E-02
9 F= -.57976252E+03 E0= -.57977032E+03 d E =-.769001E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.579767393675E+03 -0.48785E-02 -0.19946E+00 3776 0.331E+00 0.434E-01
DAV: 2 -0.579770208516E+03 -0.28148E-02 -0.42253E-02 4376 0.457E-01 0.207E-01
DAV: 3 -0.579769241698E+03 0.96682E-03 -0.20594E-03 4432 0.146E-01 0.137E-01
DAV: 4 -0.579768307823E+03 0.93388E-03 -0.14386E-03 4544 0.159E-01 0.856E-02
DAV: 5 -0.579767739347E+03 0.56848E-03 -0.12166E-03 4712 0.143E-01 0.595E-02
DAV: 6 -0.579767302039E+03 0.43731E-03 -0.30016E-04 4816 0.115E-01 0.318E-02
DAV: 7 -0.579767074249E+03 0.22779E-03 -0.75380E-04 5424 0.156E-01 0.227E-02
DAV: 8 -0.579767121416E+03 -0.47167E-04 -0.51505E-04 4264 0.542E-02 0.445E-02
DAV: 9 -0.579767118109E+03 0.33072E-05 -0.23711E-05 3408 0.110E-02
10 F= -.57976712E+03 E0= -.57977163E+03 d E =-.773601E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.579973465324E+03 -0.20634E+00 -0.13203E+02 3776 0.275E+01 0.384E+00
DAV: 2 -0.580187683074E+03 -0.21422E+00 -0.30723E+00 4384 0.397E+00 0.150E+00
DAV: 3 -0.580146533743E+03 0.41149E-01 -0.12054E-01 4472 0.948E-01 0.878E-01
DAV: 4 -0.580130884343E+03 0.15649E-01 -0.91733E-02 4440 0.709E-01 0.522E-01
DAV: 5 -0.580125951022E+03 0.49333E-02 -0.29840E-02 4464 0.467E-01 0.221E-01
DAV: 6 -0.580125511984E+03 0.43904E-03 -0.67087E-03 4416 0.251E-01 0.178E-01
DAV: 7 -0.580125142315E+03 0.36967E-03 -0.13861E-03 4440 0.115E-01 0.954E-02
DAV: 8 -0.580124842202E+03 0.30011E-03 -0.34417E-04 4872 0.994E-02 0.481E-02
DAV: 9 -0.580124698113E+03 0.14409E-03 -0.46429E-04 5096 0.945E-02 0.222E-02
DAV: 10 -0.580124681172E+03 0.16941E-04 -0.22512E-04 4568 0.518E-02 0.214E-02
DAV: 11 -0.580124674051E+03 0.71214E-05 -0.42512E-05 3680 0.196E-02
11 F= -.58012467E+03 E0= -.58013645E+03 d E =-.357556E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580128093576E+03 -0.34124E-02 -0.16870E+00 3784 0.314E+00 0.444E-01
DAV: 2 -0.580130859842E+03 -0.27663E-02 -0.39868E-02 4416 0.447E-01 0.176E-01
DAV: 3 -0.580130355779E+03 0.50406E-03 -0.40711E-03 4496 0.128E-01 0.124E-01
DAV: 4 -0.580130124846E+03 0.23093E-03 -0.16562E-03 4496 0.777E-02 0.661E-02
DAV: 5 -0.580130021134E+03 0.10371E-03 -0.52852E-04 4416 0.647E-02 0.197E-02
DAV: 6 -0.580130021777E+03 -0.64367E-06 -0.13145E-04 4424 0.322E-02 0.196E-02
DAV: 7 -0.580130016895E+03 0.48819E-05 -0.22994E-05 3208 0.143E-02
12 F= -.58013002E+03 E0= -.58014144E+03 d E =-.362899E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580261470854E+03 -0.13145E+00 -0.53951E+01 3776 0.179E+01 0.258E+00
DAV: 2 -0.580347084550E+03 -0.85614E-01 -0.12363E+00 4432 0.257E+00 0.102E+00
DAV: 3 -0.580327407606E+03 0.19677E-01 -0.68499E-02 4448 0.779E-01 0.615E-01
DAV: 4 -0.580321908000E+03 0.54996E-02 -0.35471E-02 4424 0.490E-01 0.380E-01
DAV: 5 -0.580319124209E+03 0.27838E-02 -0.16005E-02 4856 0.372E-01 0.234E-01
DAV: 6 -0.580318247911E+03 0.87630E-03 -0.52041E-03 4632 0.211E-01 0.153E-01
DAV: 7 -0.580317665074E+03 0.58284E-03 -0.16348E-03 4504 0.157E-01 0.881E-02
DAV: 8 -0.580317366228E+03 0.29885E-03 -0.66479E-04 5048 0.110E-01 0.619E-02
DAV: 9 -0.580317157646E+03 0.20858E-03 -0.17178E-04 4624 0.836E-02 0.295E-02
DAV: 10 -0.580317028157E+03 0.12949E-03 -0.12904E-04 5096 0.869E-02 0.203E-02
DAV: 11 -0.580317005618E+03 0.22539E-04 -0.20375E-04 4456 0.549E-02 0.219E-02
DAV: 12 -0.580316994994E+03 0.10624E-04 -0.32559E-05 3376 0.212E-02 0.172E-02
DAV: 13 -0.580316984108E+03 0.10886E-04 -0.51697E-06 2952 0.204E-02 0.699E-03
DAV: 14 -0.580316980883E+03 0.32248E-05 -0.14183E-05 3032 0.202E-02
13 F= -.58031698E+03 E0= -.58034417E+03 d E =-.186964E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580317602837E+03 -0.61873E-03 -0.21497E-01 3840 0.113E+00 0.166E-01
DAV: 2 -0.580317969872E+03 -0.36703E-03 -0.52655E-03 4432 0.171E-01 0.833E-02
DAV: 3 -0.580317893698E+03 0.76174E-04 -0.65697E-04 4888 0.609E-02 0.588E-02
DAV: 4 -0.580317845850E+03 0.47848E-04 -0.19645E-04 4552 0.346E-02 0.268E-02
DAV: 5 -0.580317835938E+03 0.99121E-05 -0.76507E-05 4416 0.244E-02
14 F= -.58031784E+03 E0= -.58034467E+03 d E =-.187819E+00
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580362580053E+03 -0.44734E-01 -0.36813E+01 3776 0.147E+01 0.194E+00
DAV: 2 -0.580430531106E+03 -0.67951E-01 -0.85382E-01 4392 0.208E+00 0.738E-01
DAV: 3 -0.580420330413E+03 0.10201E-01 -0.21536E-02 4464 0.460E-01 0.437E-01
DAV: 4 -0.580416791275E+03 0.35391E-02 -0.20637E-02 4448 0.441E-01 0.240E-01
DAV: 5 -0.580416037542E+03 0.75373E-03 -0.83058E-03 4504 0.221E-01 0.139E-01
DAV: 6 -0.580415777711E+03 0.25983E-03 -0.14313E-03 4408 0.121E-01 0.926E-02
DAV: 7 -0.580415535380E+03 0.24233E-03 -0.36792E-04 4824 0.881E-02 0.528E-02
DAV: 8 -0.580415306025E+03 0.22935E-03 -0.21614E-04 5304 0.936E-02 0.352E-02
DAV: 9 -0.580415072322E+03 0.23370E-03 -0.30346E-04 5456 0.125E-01 0.236E-02
DAV: 10 -0.580414977480E+03 0.94841E-04 -0.48999E-04 5152 0.110E-01 0.222E-02
DAV: 11 -0.580414973634E+03 0.38459E-05 -0.26096E-04 4456 0.499E-02 0.291E-02
DAV: 12 -0.580414972537E+03 0.10980E-05 -0.18751E-05 2856 0.106E-02
15 F= -.58041497E+03 E0= -.58043446E+03 d E =-.971366E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580415038178E+03 -0.64544E-04 -0.45509E-02 3856 0.517E-01 0.775E-02
DAV: 2 -0.580415117801E+03 -0.79623E-04 -0.11001E-03 4392 0.753E-02 0.297E-02
DAV: 3 -0.580415104538E+03 0.13263E-04 -0.37961E-05 3760 0.187E-02 0.169E-02
DAV: 4 -0.580415099658E+03 0.48800E-05 -0.27307E-05 2968 0.164E-02
16 F= -.58041510E+03 E0= -.58043462E+03 d E =-.972637E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580454134837E+03 -0.39030E-01 -0.33006E+01 3776 0.138E+01 0.139E+00
DAV: 2 -0.580512137637E+03 -0.58003E-01 -0.70170E-01 4376 0.186E+00 0.628E-01
DAV: 3 -0.580504961410E+03 0.71762E-02 -0.20751E-02 4480 0.405E-01 0.399E-01
DAV: 4 -0.580500963983E+03 0.39974E-02 -0.16685E-02 4608 0.373E-01 0.298E-01
DAV: 5 -0.580498740663E+03 0.22233E-02 -0.13443E-02 5168 0.335E-01 0.166E-01
DAV: 6 -0.580498283373E+03 0.45729E-03 -0.27430E-03 4456 0.160E-01 0.101E-01
DAV: 7 -0.580497915134E+03 0.36824E-03 -0.78229E-04 4448 0.103E-01 0.480E-02
DAV: 8 -0.580497714918E+03 0.20022E-03 -0.18986E-04 4936 0.901E-02 0.307E-02
DAV: 9 -0.580497591313E+03 0.12360E-03 -0.17216E-04 5000 0.978E-02 0.166E-02
DAV: 10 -0.580497578315E+03 0.12998E-04 -0.22718E-04 4480 0.561E-02 0.222E-02
DAV: 11 -0.580497576257E+03 0.20577E-05 -0.49620E-05 3456 0.184E-02
17 F= -.58049758E+03 E0= -.58052595E+03 d E =-.824766E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580497284040E+03 0.29427E-03 -0.23449E+00 3792 0.370E+00 0.369E-01
DAV: 2 -0.580501583206E+03 -0.42992E-02 -0.51075E-02 4408 0.500E-01 0.194E-01
DAV: 3 -0.580501184729E+03 0.39848E-03 -0.33400E-03 5104 0.129E-01 0.156E-01
DAV: 4 -0.580500878527E+03 0.30620E-03 -0.14415E-03 5032 0.836E-02 0.813E-02
DAV: 5 -0.580500738569E+03 0.13996E-03 -0.63997E-04 4424 0.797E-02 0.209E-02
DAV: 6 -0.580500745286E+03 -0.67168E-05 -0.19334E-04 4456 0.373E-02 0.217E-02
DAV: 7 -0.580500738754E+03 0.65322E-05 -0.24019E-05 2952 0.164E-02
18 F= -.58050074E+03 E0= -.58052949E+03 d E =-.856391E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580534900973E+03 -0.34156E-01 -0.21596E+01 3776 0.112E+01 0.109E+00
DAV: 2 -0.580574787660E+03 -0.39887E-01 -0.47301E-01 4408 0.154E+00 0.531E-01
DAV: 3 -0.580571041524E+03 0.37461E-02 -0.23497E-02 4624 0.351E-01 0.381E-01
DAV: 4 -0.580569289985E+03 0.17515E-02 -0.12687E-02 4784 0.237E-01 0.253E-01
DAV: 5 -0.580568051120E+03 0.12389E-02 -0.64462E-03 4440 0.218E-01 0.653E-02
DAV: 6 -0.580568095179E+03 -0.44059E-04 -0.14060E-03 4456 0.103E-01 0.609E-02
DAV: 7 -0.580568046098E+03 0.49081E-04 -0.32388E-04 4392 0.566E-02 0.356E-02
DAV: 8 -0.580568015928E+03 0.30170E-04 -0.32300E-05 3464 0.298E-02 0.233E-02
DAV: 9 -0.580567975834E+03 0.40094E-04 -0.30697E-05 3872 0.441E-02 0.846E-03
DAV: 10 -0.580567962844E+03 0.12990E-04 -0.54880E-05 4160 0.357E-02 0.100E-02
DAV: 11 -0.580567959630E+03 0.32139E-05 -0.28280E-05 3408 0.199E-02
19 F= -.58056796E+03 E0= -.58059470E+03 d E =-.672209E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580568796771E+03 -0.83393E-03 -0.62898E+00 3776 0.606E+00 0.582E-01
DAV: 2 -0.580580121653E+03 -0.11325E-01 -0.13720E-01 4416 0.831E-01 0.282E-01
DAV: 3 -0.580578931207E+03 0.11904E-02 -0.65611E-03 4528 0.191E-01 0.195E-01
DAV: 4 -0.580578381756E+03 0.54945E-03 -0.40141E-03 4776 0.135E-01 0.132E-01
DAV: 5 -0.580577903483E+03 0.47827E-03 -0.17369E-03 4440 0.131E-01 0.398E-02
DAV: 6 -0.580577866942E+03 0.36540E-04 -0.56527E-04 4472 0.745E-02 0.384E-02
DAV: 7 -0.580577794604E+03 0.72338E-04 -0.12452E-04 4400 0.505E-02 0.234E-02
DAV: 8 -0.580577732425E+03 0.62179E-04 -0.44075E-05 4064 0.491E-02 0.167E-02
DAV: 9 -0.580577642057E+03 0.90368E-04 -0.98713E-05 5264 0.892E-02 0.120E-02
DAV: 10 -0.580577620369E+03 0.21688E-04 -0.24684E-04 4936 0.717E-02 0.136E-02
DAV: 11 -0.580577626424E+03 -0.60557E-05 -0.10987E-04 4424 0.269E-02 0.178E-02
DAV: 12 -0.580577624709E+03 0.17150E-05 -0.29286E-06 2432 0.470E-03
20 F= -.58057762E+03 E0= -.58059960E+03 d E =-.768860E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580604815278E+03 -0.27189E-01 -0.14433E+01 3776 0.918E+00 0.884E-01
DAV: 2 -0.580632480027E+03 -0.27665E-01 -0.32354E-01 4416 0.126E+00 0.424E-01
DAV: 3 -0.580629804560E+03 0.26755E-02 -0.97304E-03 4440 0.251E-01 0.271E-01
DAV: 4 -0.580628832350E+03 0.97221E-03 -0.88196E-03 4616 0.212E-01 0.189E-01
DAV: 5 -0.580628225614E+03 0.60674E-03 -0.39637E-03 4424 0.148E-01 0.602E-02
DAV: 6 -0.580628207772E+03 0.17842E-04 -0.69772E-04 4456 0.805E-02 0.480E-02
DAV: 7 -0.580628179716E+03 0.28056E-04 -0.16912E-04 4416 0.394E-02 0.311E-02
DAV: 8 -0.580628144522E+03 0.35194E-04 -0.20532E-05 3168 0.306E-02 0.186E-02
DAV: 9 -0.580628097772E+03 0.46750E-04 -0.53887E-05 4448 0.545E-02 0.101E-02
DAV: 10 -0.580628081234E+03 0.16538E-04 -0.84161E-05 4568 0.416E-02 0.116E-02
DAV: 11 -0.580628074495E+03 0.67388E-05 -0.31431E-05 3576 0.234E-02
21 F= -.58062807E+03 E0= -.58065436E+03 d E =-.504498E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580628012751E+03 0.68483E-04 -0.52048E+00 3776 0.551E+00 0.529E-01
DAV: 2 -0.580637987149E+03 -0.99744E-02 -0.11624E-01 4416 0.756E-01 0.256E-01
DAV: 3 -0.580637043173E+03 0.94398E-03 -0.36837E-03 4456 0.152E-01 0.168E-01
DAV: 4 -0.580636697029E+03 0.34614E-03 -0.30081E-03 4720 0.123E-01 0.119E-01
DAV: 5 -0.580636435360E+03 0.26167E-03 -0.13506E-03 4440 0.975E-02 0.349E-02
DAV: 6 -0.580636426935E+03 0.84248E-05 -0.30419E-04 4472 0.542E-02 0.301E-02
DAV: 7 -0.580636411150E+03 0.15785E-04 -0.71212E-05 4416 0.276E-02 0.198E-02
DAV: 8 -0.580636391571E+03 0.19578E-04 -0.54323E-06 2896 0.228E-02 0.125E-02
DAV: 9 -0.580636359599E+03 0.31972E-04 -0.29994E-05 3920 0.508E-02 0.712E-03
DAV: 10 -0.580636354200E+03 0.53995E-05 -0.67848E-05 4152 0.350E-02
22 F= -.58063635E+03 E0= -.58066506E+03 d E =-.587295E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580651073554E+03 -0.14714E-01 -0.15369E+01 3776 0.952E+00 0.967E-01
DAV: 2 -0.580679836975E+03 -0.28763E-01 -0.34390E-01 4416 0.130E+00 0.450E-01
DAV: 3 -0.580676971452E+03 0.28655E-02 -0.16908E-02 4456 0.298E-01 0.299E-01
DAV: 4 -0.580675706730E+03 0.12647E-02 -0.78109E-03 4448 0.198E-01 0.179E-01
DAV: 5 -0.580675098680E+03 0.60805E-03 -0.33168E-03 4448 0.174E-01 0.499E-02
DAV: 6 -0.580675133452E+03 -0.34772E-04 -0.89067E-04 4424 0.802E-02 0.531E-02
DAV: 7 -0.580675110092E+03 0.23361E-04 -0.12328E-04 4432 0.309E-02 0.328E-02
DAV: 8 -0.580675090065E+03 0.20026E-04 -0.76721E-06 2904 0.192E-02 0.208E-02
DAV: 9 -0.580675063518E+03 0.26547E-04 -0.26546E-05 3632 0.373E-02 0.789E-03
DAV: 10 -0.580675054155E+03 0.93630E-05 -0.45362E-05 4072 0.325E-02
23 F= -.58067505E+03 E0= -.58070166E+03 d E =-.387000E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580674715240E+03 0.34828E-03 -0.24506E+00 3776 0.380E+00 0.383E-01
DAV: 2 -0.580679226095E+03 -0.45109E-02 -0.53724E-02 4424 0.516E-01 0.173E-01
DAV: 3 -0.580678759440E+03 0.46666E-03 -0.21981E-03 4464 0.113E-01 0.113E-01
DAV: 4 -0.580678569192E+03 0.19025E-03 -0.11790E-03 4416 0.803E-02 0.694E-02
DAV: 5 -0.580678462034E+03 0.10716E-03 -0.52798E-04 4448 0.710E-02 0.207E-02
DAV: 6 -0.580678460085E+03 0.19496E-05 -0.15413E-04 4456 0.367E-02 0.223E-02
DAV: 7 -0.580678450872E+03 0.92121E-05 -0.21944E-05 3000 0.165E-02
24 F= -.58067845E+03 E0= -.58070369E+03 d E =-.420967E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580687610652E+03 -0.91506E-02 -0.11886E+01 3776 0.834E+00 0.766E-01
DAV: 2 -0.580709507322E+03 -0.21897E-01 -0.25922E-01 4416 0.114E+00 0.370E-01
DAV: 3 -0.580707584123E+03 0.19232E-02 -0.66463E-03 4464 0.221E-01 0.229E-01
DAV: 4 -0.580706819340E+03 0.76478E-03 -0.54461E-03 4552 0.193E-01 0.143E-01
DAV: 5 -0.580706588902E+03 0.23044E-03 -0.27147E-03 4552 0.115E-01 0.651E-02
DAV: 6 -0.580706560572E+03 0.28330E-04 -0.37383E-04 4424 0.561E-02 0.472E-02
DAV: 7 -0.580706541081E+03 0.19491E-04 -0.14282E-04 4408 0.362E-02 0.253E-02
DAV: 8 -0.580706525145E+03 0.15935E-04 -0.16093E-05 2976 0.243E-02 0.140E-02
DAV: 9 -0.580706509380E+03 0.15766E-04 -0.21793E-05 3320 0.298E-02 0.647E-03
DAV: 10 -0.580706501527E+03 0.78530E-05 -0.27849E-05 3488 0.257E-02
25 F= -.58070650E+03 E0= -.58073279E+03 d E =-.280507E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580706284116E+03 0.22526E-03 -0.12739E+00 3776 0.273E+00 0.250E-01
DAV: 2 -0.580708592853E+03 -0.23087E-02 -0.27550E-02 4416 0.373E-01 0.122E-01
DAV: 3 -0.580708376504E+03 0.21635E-03 -0.75347E-04 4464 0.747E-02 0.766E-02
DAV: 4 -0.580708288679E+03 0.87825E-04 -0.62143E-04 4656 0.645E-02 0.524E-02
DAV: 5 -0.580708244965E+03 0.43714E-04 -0.31229E-04 4488 0.426E-02 0.213E-02
DAV: 6 -0.580708238668E+03 0.62969E-05 -0.55337E-05 4376 0.234E-02
26 F= -.58070824E+03 E0= -.58073520E+03 d E =-.297878E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580715499389E+03 -0.72544E-02 -0.11961E+01 3776 0.838E+00 0.818E-01
DAV: 2 -0.580737925212E+03 -0.22426E-01 -0.26591E-01 4408 0.115E+00 0.373E-01
DAV: 3 -0.580736155622E+03 0.17696E-02 -0.10183E-02 4472 0.235E-01 0.246E-01
DAV: 4 -0.580735433815E+03 0.72181E-03 -0.48334E-03 4472 0.159E-01 0.161E-01
DAV: 5 -0.580735073434E+03 0.36038E-03 -0.28619E-03 4432 0.143E-01 0.551E-02
DAV: 6 -0.580735068854E+03 0.45798E-05 -0.53360E-04 4408 0.654E-02 0.467E-02
DAV: 7 -0.580735052164E+03 0.16690E-04 -0.18939E-04 4408 0.393E-02 0.244E-02
DAV: 8 -0.580735040795E+03 0.11369E-04 -0.19076E-05 3048 0.209E-02 0.150E-02
DAV: 9 -0.580735026988E+03 0.13807E-04 -0.11582E-05 3032 0.272E-02 0.608E-03
DAV: 10 -0.580735020160E+03 0.68279E-05 -0.29702E-05 3688 0.270E-02
27 F= -.58073502E+03 E0= -.58076317E+03 d E =-.267815E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580731717623E+03 0.33094E-02 -0.47435E+00 3776 0.528E+00 0.513E-01
DAV: 2 -0.580740560398E+03 -0.88428E-02 -0.10491E-01 4408 0.721E-01 0.238E-01
DAV: 3 -0.580739862256E+03 0.69814E-03 -0.42695E-03 4472 0.151E-01 0.161E-01
DAV: 4 -0.580739554039E+03 0.30822E-03 -0.18723E-03 4488 0.993E-02 0.105E-01
DAV: 5 -0.580739394063E+03 0.15998E-03 -0.11590E-03 4424 0.946E-02 0.336E-02
DAV: 6 -0.580739396184E+03 -0.21210E-05 -0.23012E-04 4408 0.420E-02 0.295E-02
DAV: 7 -0.580739390309E+03 0.58756E-05 -0.73702E-05 4360 0.239E-02
28 F= -.58073939E+03 E0= -.58076782E+03 d E =-.311516E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580740953464E+03 -0.15573E-02 -0.12268E+01 3776 0.854E+00 0.779E-01
DAV: 2 -0.580763921208E+03 -0.22968E-01 -0.26806E-01 4416 0.116E+00 0.366E-01
DAV: 3 -0.580762075376E+03 0.18458E-02 -0.64040E-03 4480 0.217E-01 0.234E-01
DAV: 4 -0.580761282155E+03 0.79322E-03 -0.53337E-03 4504 0.200E-01 0.157E-01
DAV: 5 -0.580760896392E+03 0.38576E-03 -0.27961E-03 4496 0.141E-01 0.686E-02
DAV: 6 -0.580760845567E+03 0.50826E-04 -0.52252E-04 4440 0.687E-02 0.550E-02
DAV: 7 -0.580760779730E+03 0.65836E-04 -0.15370E-04 4408 0.408E-02 0.322E-02
DAV: 8 -0.580760674348E+03 0.10538E-03 -0.39475E-05 4136 0.594E-02 0.214E-02
DAV: 9 -0.580760575808E+03 0.98540E-04 -0.13696E-04 5056 0.706E-02 0.203E-02
DAV: 10 -0.580760494391E+03 0.81417E-04 -0.11449E-04 5416 0.654E-02 0.175E-02
DAV: 11 -0.580760360963E+03 0.13343E-03 -0.30482E-05 5000 0.938E-02 0.170E-02
DAV: 12 -0.580760203851E+03 0.15711E-03 -0.28404E-04 5072 0.132E-01 0.205E-02
DAV: 13 -0.580760200096E+03 0.37556E-05 -0.55005E-04 4456 0.717E-02 0.222E-02
DAV: 14 -0.580760193765E+03 0.63308E-05 -0.65290E-05 3928 0.225E-02
29 F= -.58076019E+03 E0= -.58078168E+03 d E =-.208035E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580759942304E+03 0.25779E-03 -0.62570E-01 3800 0.193E+00 0.176E-01
DAV: 2 -0.580761068562E+03 -0.11263E-02 -0.13603E-02 4424 0.262E-01 0.834E-02
DAV: 3 -0.580760953228E+03 0.11533E-03 -0.32149E-04 4472 0.507E-02 0.533E-02
DAV: 4 -0.580760863916E+03 0.89313E-04 -0.24711E-04 4592 0.597E-02 0.265E-02
DAV: 5 -0.580760838809E+03 0.25107E-04 -0.15085E-04 4552 0.375E-02 0.209E-02
DAV: 6 -0.580760824523E+03 0.14286E-04 -0.35412E-05 3880 0.207E-02 0.157E-02
DAV: 7 -0.580760804976E+03 0.19547E-04 -0.69320E-06 2960 0.197E-02 0.113E-02
DAV: 8 -0.580760766562E+03 0.38413E-04 -0.47036E-05 4352 0.506E-02 0.121E-02
DAV: 9 -0.580760746249E+03 0.20314E-04 -0.96790E-05 5120 0.522E-02 0.113E-02
DAV: 10 -0.580760746039E+03 0.20971E-06 -0.61965E-05 4424 0.249E-02
30 F= -.58076075E+03 E0= -.58077968E+03 d E =-.213557E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580758971115E+03 0.17751E-02 -0.10659E+01 3776 0.797E+00 0.785E-01
DAV: 2 -0.580778614459E+03 -0.19643E-01 -0.23663E-01 4432 0.110E+00 0.354E-01
DAV: 3 -0.580776346911E+03 0.22675E-02 -0.73560E-03 4480 0.247E-01 0.234E-01
DAV: 4 -0.580774934450E+03 0.14125E-02 -0.53361E-03 4840 0.227E-01 0.158E-01
DAV: 5 -0.580773661128E+03 0.12733E-02 -0.26254E-03 4616 0.216E-01 0.892E-02
DAV: 6 -0.580773208184E+03 0.45294E-03 -0.15893E-03 4448 0.145E-01 0.832E-02
DAV: 7 -0.580772623288E+03 0.58490E-03 -0.24071E-04 4704 0.119E-01 0.581E-02
DAV: 8 -0.580771676400E+03 0.94689E-03 -0.60670E-04 6416 0.240E-01 0.445E-02
DAV: 9 -0.580771459249E+03 0.21715E-03 -0.13618E-03 4456 0.149E-01 0.430E-02
DAV: 10 -0.580771268283E+03 0.19097E-03 -0.15210E-04 5120 0.132E-01 0.393E-02
DAV: 11 -0.580771317871E+03 -0.49588E-04 -0.28447E-04 4992 0.837E-02 0.413E-02
DAV: 12 -0.580771221613E+03 0.96258E-04 -0.13603E-04 4480 0.639E-02 0.194E-02
DAV: 13 -0.580771199583E+03 0.22030E-04 -0.69713E-05 4400 0.515E-02 0.127E-02
DAV: 14 -0.580771208853E+03 -0.92694E-05 -0.13510E-04 4328 0.291E-02 0.232E-02
DAV: 15 -0.580771201026E+03 0.78263E-05 -0.11289E-05 2808 0.144E-02
31 F= -.58077120E+03 E0= -.58080311E+03 d E =-.104550E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580771069969E+03 0.13888E-03 -0.51577E-01 3776 0.176E+00 0.173E-01
DAV: 2 -0.580772046918E+03 -0.97695E-03 -0.11406E-02 4424 0.240E-01 0.760E-02
DAV: 3 -0.580771961534E+03 0.85384E-04 -0.25679E-04 4472 0.460E-02 0.474E-02
DAV: 4 -0.580771929049E+03 0.32485E-04 -0.20931E-04 4544 0.420E-02 0.310E-02
DAV: 5 -0.580771918426E+03 0.10623E-04 -0.10504E-04 4416 0.261E-02 0.152E-02
DAV: 6 -0.580771916663E+03 0.17628E-05 -0.15933E-05 2512 0.125E-02
32 F= -.58077192E+03 E0= -.58080335E+03 d E =-.111706E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580772808750E+03 -0.89032E-03 -0.84674E+00 3776 0.713E+00 0.662E-01
DAV: 2 -0.580788922001E+03 -0.16113E-01 -0.18586E-01 4416 0.970E-01 0.311E-01
DAV: 3 -0.580787678141E+03 0.12439E-02 -0.50300E-03 4488 0.198E-01 0.210E-01
DAV: 4 -0.580787196996E+03 0.48115E-03 -0.32929E-03 4688 0.145E-01 0.146E-01
DAV: 5 -0.580786848158E+03 0.34884E-03 -0.18594E-03 4488 0.135E-01 0.467E-02
DAV: 6 -0.580786851532E+03 -0.33740E-05 -0.50270E-04 4456 0.626E-02 0.440E-02
DAV: 7 -0.580786830396E+03 0.21136E-04 -0.12620E-04 4416 0.314E-02 0.247E-02
DAV: 8 -0.580786809901E+03 0.20495E-04 -0.53747E-06 2936 0.230E-02 0.139E-02
DAV: 9 -0.580786787525E+03 0.22376E-04 -0.14979E-05 3320 0.357E-02 0.635E-03
DAV: 10 -0.580786778368E+03 0.91566E-05 -0.40353E-05 4032 0.353E-02
33 F= -.58078678E+03 E0= -.58081662E+03 d E =-.148617E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580786615858E+03 0.17167E-03 -0.41980E-01 3784 0.159E+00 0.146E-01
DAV: 2 -0.580787405888E+03 -0.79003E-03 -0.91939E-03 4416 0.216E-01 0.687E-02
DAV: 3 -0.580787338781E+03 0.67107E-04 -0.23124E-04 4480 0.433E-02 0.455E-02
DAV: 4 -0.580787309536E+03 0.29245E-04 -0.15937E-04 4504 0.358E-02 0.314E-02
DAV: 5 -0.580787287668E+03 0.21868E-04 -0.99867E-05 4416 0.342E-02 0.123E-02
DAV: 6 -0.580787285374E+03 0.22939E-05 -0.31410E-05 3592 0.170E-02
34 F= -.58078729E+03 E0= -.58081652E+03 d E =-.153687E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580789204469E+03 -0.19168E-02 -0.53518E+00 3776 0.568E+00 0.541E-01
DAV: 2 -0.580799591013E+03 -0.10387E-01 -0.12073E-01 4440 0.786E-01 0.248E-01
DAV: 3 -0.580798589952E+03 0.10011E-02 -0.28924E-03 4488 0.160E-01 0.158E-01
DAV: 4 -0.580798075722E+03 0.51423E-03 -0.20309E-03 4512 0.146E-01 0.109E-01
DAV: 5 -0.580797721118E+03 0.35460E-03 -0.14637E-03 4952 0.132E-01 0.521E-02
DAV: 6 -0.580797630919E+03 0.90199E-04 -0.48077E-04 4440 0.678E-02 0.504E-02
DAV: 7 -0.580797527876E+03 0.10304E-03 -0.57912E-05 4432 0.368E-02 0.393E-02
DAV: 8 -0.580797248230E+03 0.27965E-03 -0.10428E-04 5360 0.919E-02 0.356E-02
DAV: 9 -0.580797310027E+03 -0.61797E-04 -0.90780E-05 4336 0.253E-02 0.367E-02
DAV: 10 -0.580797191475E+03 0.11855E-03 -0.19322E-05 3168 0.364E-02 0.338E-02
DAV: 11 -0.580797183828E+03 0.76474E-05 -0.11838E-03 4416 0.950E-02 0.147E-01
DAV: 12 -0.580797660906E+03 -0.47708E-03 -0.32208E-04 6056 0.132E-01 0.161E-01
DAV: 13 -0.580797910856E+03 -0.24995E-03 -0.47415E-04 4520 0.867E-02 0.172E-01
DAV: 14 -0.580797797454E+03 0.11340E-03 -0.17894E-04 4512 0.511E-02 0.189E-01
DAV: 15 -0.580797718448E+03 0.79006E-04 -0.55717E-05 3968 0.236E-02 0.179E-01
DAV: 16 -0.580797360197E+03 0.35825E-03 -0.14346E-04 5632 0.110E-01 0.177E-01
DAV: 17 -0.580799264521E+03 -0.19043E-02 -0.24289E-03 6712 0.538E-01 0.264E-01
DAV: 18 -0.580799869590E+03 -0.60507E-03 -0.34550E-03 4384 0.113E-01 0.316E-01
DAV: 19 -0.580799435178E+03 0.43441E-03 -0.13993E-04 4848 0.692E-02 0.304E-01
DAV: 20 -0.580798937564E+03 0.49761E-03 -0.42147E-04 4232 0.799E-02 0.254E-01
DAV: 21 -0.580798211066E+03 0.72650E-03 -0.39271E-04 5704 0.167E-01 0.209E-01
DAV: 22 -0.580797862864E+03 0.34820E-03 -0.14326E-03 4440 0.116E-01 0.130E-01
DAV: 23 -0.580797604040E+03 0.25882E-03 -0.38664E-04 4688 0.880E-02 0.107E-01
DAV: 24 -0.580797598259E+03 0.57808E-05 -0.12662E-04 4384 0.284E-02 0.106E-01
DAV: 25 -0.580797545549E+03 0.52709E-04 -0.34434E-06 2936 0.191E-02 0.106E-01
DAV: 26 -0.580797537251E+03 0.82989E-05 -0.77552E-05 4424 0.419E-02
35 F= -.58079754E+03 E0= -.58082196E+03 d E =-.102519E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580797450771E+03 0.94778E-04 -0.10023E-01 3792 0.777E-01 0.129E-01
DAV: 2 -0.580797235552E+03 0.21522E-03 -0.33066E-03 4400 0.172E-01 0.718E-02
DAV: 3 -0.580797028358E+03 0.20719E-03 -0.94274E-04 4424 0.101E-01 0.579E-02
DAV: 4 -0.580796864210E+03 0.16415E-03 -0.17941E-04 5080 0.563E-02 0.508E-02
DAV: 5 -0.580796638392E+03 0.22582E-03 -0.82459E-05 4792 0.645E-02 0.459E-02
DAV: 6 -0.580796256306E+03 0.38209E-03 -0.27830E-04 5336 0.120E-01 0.434E-02
DAV: 7 -0.580795805002E+03 0.45130E-03 -0.77301E-04 5728 0.174E-01 0.356E-02
DAV: 8 -0.580795307674E+03 0.49733E-03 -0.13624E-03 5768 0.314E-01 0.250E-02
DAV: 9 -0.580795501337E+03 -0.19366E-03 -0.16757E-03 4336 0.968E-02 0.644E-02
DAV: 10 -0.580795498049E+03 0.32884E-05 -0.63599E-05 4256 0.208E-02
36 F= -.58079550E+03 E0= -.58081003E+03 d E =-.821267E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580799205981E+03 -0.37046E-02 -0.12360E+00 3776 0.272E+00 0.257E-01
DAV: 2 -0.580801614332E+03 -0.24084E-02 -0.28083E-02 4432 0.380E-01 0.117E-01
DAV: 3 -0.580801424233E+03 0.19010E-03 -0.68288E-04 4464 0.699E-02 0.724E-02
DAV: 4 -0.580801335609E+03 0.88625E-04 -0.41389E-04 4488 0.599E-02 0.336E-02
DAV: 5 -0.580801324186E+03 0.11423E-04 -0.15409E-04 4416 0.329E-02 0.200E-02
DAV: 6 -0.580801319109E+03 0.50767E-05 -0.36029E-05 3472 0.191E-02
37 F= -.58080132E+03 E0= -.58081755E+03 d E =-.582106E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580799246061E+03 0.20781E-02 -0.34057E+00 3776 0.452E+00 0.423E-01
DAV: 2 -0.580805763758E+03 -0.65177E-02 -0.75522E-02 4440 0.621E-01 0.190E-01
DAV: 3 -0.580805161748E+03 0.60201E-03 -0.17016E-03 4472 0.122E-01 0.121E-01
DAV: 4 -0.580804790118E+03 0.37163E-03 -0.13949E-03 4728 0.126E-01 0.660E-02
DAV: 5 -0.580804659828E+03 0.13029E-03 -0.65682E-04 4456 0.816E-02 0.431E-02
DAV: 6 -0.580804599581E+03 0.60247E-04 -0.20054E-04 4456 0.489E-02 0.356E-02
DAV: 7 -0.580804525234E+03 0.74347E-04 -0.45727E-05 4208 0.392E-02 0.253E-02
DAV: 8 -0.580804401721E+03 0.12351E-03 -0.80493E-05 4840 0.693E-02 0.239E-02
DAV: 9 -0.580804375173E+03 0.26548E-04 -0.14047E-04 4472 0.337E-02 0.241E-02
DAV: 10 -0.580804310618E+03 0.64555E-04 -0.12395E-06 3048 0.327E-02 0.232E-02
DAV: 11 -0.580804274601E+03 0.36017E-04 -0.34153E-05 3808 0.217E-02 0.227E-02
DAV: 12 -0.580803974829E+03 0.29977E-03 -0.17992E-04 5600 0.148E-01 0.603E-02
DAV: 13 -0.580803718800E+03 0.25603E-03 -0.61173E-04 5272 0.149E-01 0.876E-02
DAV: 14 -0.580803776713E+03 -0.57913E-04 -0.47508E-04 4304 0.475E-02 0.513E-02
DAV: 15 -0.580803665524E+03 0.11119E-03 -0.25773E-05 4520 0.689E-02 0.626E-02
DAV: 16 -0.580803676950E+03 -0.11427E-04 -0.67346E-05 4156 0.256E-02 0.495E-02
DAV: 17 -0.580803442322E+03 0.23463E-03 -0.35862E-04 5848 0.227E-01 0.902E-02
DAV: 18 -0.580803484214E+03 -0.41893E-04 -0.39894E-04 4872 0.924E-02 0.549E-02
DAV: 19 -0.580803430250E+03 0.53964E-04 -0.61512E-05 4496 0.575E-02 0.681E-02
DAV: 20 -0.580803372339E+03 0.57910E-04 -0.13394E-04 5256 0.608E-02 0.640E-02
DAV: 21 -0.580803427888E+03 -0.55548E-04 -0.12902E-04 4728 0.582E-02 0.408E-02
DAV: 22 -0.580803344411E+03 0.83477E-04 0.29131E-05 3848 0.807E-02 0.382E-02
DAV: 23 -0.580803243301E+03 0.10111E-03 -0.21096E-04 5376 0.135E-01 0.363E-02
DAV: 24 -0.580803293000E+03 -0.49699E-04 -0.23738E-04 4544 0.637E-02 0.213E-02
DAV: 25 -0.580803260209E+03 0.32791E-04 -0.29094E-06 3664 0.576E-02 0.180E-02
DAV: 26 -0.580803260212E+03 -0.30632E-08 -0.95193E-05 4384 0.332E-02
38 F= -.58080326E+03 E0= -.58083344E+03 d E =-.776216E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580803383349E+03 -0.12314E-03 -0.27610E-01 3784 0.129E+00 0.121E-01
DAV: 2 -0.580803920317E+03 -0.53697E-03 -0.61573E-03 4416 0.176E-01 0.563E-02
DAV: 3 -0.580803872159E+03 0.48158E-04 -0.15690E-04 4480 0.376E-02 0.371E-02
DAV: 4 -0.580803852551E+03 0.19608E-04 -0.12600E-04 4480 0.322E-02 0.278E-02
DAV: 5 -0.580803834122E+03 0.18429E-04 -0.60996E-05 4200 0.288E-02 0.921E-03
DAV: 6 -0.580803831364E+03 0.27581E-05 -0.20317E-05 2832 0.160E-02
39 F= -.58080383E+03 E0= -.58083374E+03 d E =-.833331E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580809141572E+03 -0.53074E-02 -0.64908E-01 3776 0.198E+00 0.183E-01
DAV: 2 -0.580810411388E+03 -0.12698E-02 -0.14556E-02 4424 0.273E-01 0.847E-02
DAV: 3 -0.580810306183E+03 0.10521E-03 -0.32379E-04 4480 0.508E-02 0.535E-02
DAV: 4 -0.580810267737E+03 0.38445E-04 -0.27379E-04 4856 0.459E-02 0.414E-02
DAV: 5 -0.580810241914E+03 0.25823E-04 -0.15045E-04 4480 0.339E-02 0.141E-02
DAV: 6 -0.580810240749E+03 0.11653E-05 -0.28749E-05 3256 0.168E-02
40 F= -.58081024E+03 E0= -.58083997E+03 d E =-.640938E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580809856930E+03 0.38498E-03 -0.40558E+00 3776 0.494E+00 0.461E-01
DAV: 2 -0.580817893867E+03 -0.80369E-02 -0.91727E-02 4424 0.684E-01 0.212E-01
DAV: 3 -0.580817253010E+03 0.64086E-03 -0.21390E-03 4480 0.129E-01 0.135E-01
DAV: 4 -0.580817040418E+03 0.21259E-03 -0.17453E-03 4840 0.110E-01 0.107E-01
DAV: 5 -0.580816871135E+03 0.16928E-03 -0.95821E-04 4648 0.855E-02 0.335E-02
DAV: 6 -0.580816870863E+03 0.27246E-06 -0.20229E-04 4448 0.420E-02 0.299E-02
DAV: 7 -0.580816861166E+03 0.96967E-05 -0.53420E-05 4376 0.223E-02
41 F= -.58081686E+03 E0= -.58084675E+03 d E =-.130298E-01
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580821194374E+03 -0.43235E-02 -0.89913E-01 3776 0.233E+00 0.213E-01
DAV: 2 -0.580822924194E+03 -0.17298E-02 -0.19944E-02 4416 0.319E-01 0.963E-02
DAV: 3 -0.580822760668E+03 0.16353E-03 -0.35837E-04 4472 0.602E-02 0.595E-02
DAV: 4 -0.580822630304E+03 0.13036E-03 -0.30714E-04 4496 0.808E-02 0.220E-02
DAV: 5 -0.580822624499E+03 0.58051E-05 -0.22262E-04 4472 0.428E-02 0.249E-02
DAV: 6 -0.580822612337E+03 0.12162E-04 -0.27372E-05 3112 0.163E-02 0.184E-02
DAV: 7 -0.580822586594E+03 0.25742E-04 -0.96858E-06 2960 0.244E-02 0.121E-02
DAV: 8 -0.580822547992E+03 0.38602E-04 -0.33067E-05 4056 0.467E-02 0.125E-02
DAV: 9 -0.580822523617E+03 0.24375E-04 -0.66081E-05 4392 0.441E-02 0.122E-02
DAV: 10 -0.580822503089E+03 0.20529E-04 -0.33421E-05 3952 0.421E-02 0.835E-03
DAV: 11 -0.580822468342E+03 0.34747E-04 0.33158E-06 3848 0.709E-02 0.959E-03
DAV: 12 -0.580822460654E+03 0.76876E-05 -0.14105E-04 4704 0.542E-02 0.906E-03
DAV: 13 -0.580822461146E+03 -0.49217E-06 -0.62057E-05 4160 0.273E-02
42 F= -.58082246E+03 E0= -.58084810E+03 d E =-.559998E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580822854683E+03 -0.39403E-03 -0.19684E+00 3776 0.344E+00 0.312E-01
DAV: 2 -0.580826538794E+03 -0.36841E-02 -0.43282E-02 4408 0.472E-01 0.144E-01
DAV: 3 -0.580826126032E+03 0.41276E-03 -0.87252E-04 4480 0.970E-02 0.914E-02
DAV: 4 -0.580825688554E+03 0.43748E-03 -0.76733E-04 5080 0.141E-01 0.415E-02
DAV: 5 -0.580825616130E+03 0.72424E-04 -0.68890E-04 4472 0.794E-02 0.461E-02
DAV: 6 -0.580825564118E+03 0.52012E-04 -0.92488E-05 4416 0.283E-02 0.398E-02
DAV: 7 -0.580825428806E+03 0.13531E-03 -0.44429E-05 3728 0.471E-02 0.355E-02
DAV: 8 -0.580825328148E+03 0.10066E-03 -0.90001E-05 4552 0.409E-02 0.339E-02
DAV: 9 -0.580825089377E+03 0.23877E-03 -0.14682E-04 5248 0.908E-02 0.347E-02
DAV: 10 -0.580824788295E+03 0.30108E-03 -0.57616E-04 5528 0.129E-01 0.329E-02
DAV: 11 -0.580824491752E+03 0.29654E-03 -0.69888E-04 5496 0.153E-01 0.240E-02
DAV: 12 -0.580824260863E+03 0.23089E-03 -0.19705E-03 6304 0.345E-01 0.390E-02
DAV: 13 -0.580824363201E+03 -0.10234E-03 -0.15879E-03 4544 0.144E-01 0.683E-02
DAV: 14 -0.580824380750E+03 -0.17550E-04 -0.19519E-04 4608 0.287E-02 0.539E-02
DAV: 15 -0.580824366718E+03 0.14032E-04 -0.72573E-05 4784 0.612E-02 0.478E-02
DAV: 16 -0.580824348699E+03 0.18019E-04 -0.17769E-04 4728 0.589E-02 0.302E-02
DAV: 17 -0.580824363719E+03 -0.15020E-04 -0.79500E-05 4624 0.401E-02 0.341E-02
DAV: 18 -0.580824358734E+03 0.49851E-05 -0.25529E-05 3272 0.149E-02
43 F= -.58082436E+03 E0= -.58083796E+03 d E =-.749757E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580826736358E+03 -0.23726E-02 -0.27864E-01 3792 0.129E+00 0.116E-01
DAV: 2 -0.580827258795E+03 -0.52244E-03 -0.62492E-03 4368 0.180E-01 0.565E-02
DAV: 3 -0.580827220359E+03 0.38435E-04 -0.16581E-04 4480 0.345E-02 0.345E-02
DAV: 4 -0.580827200821E+03 0.19539E-04 -0.68626E-05 4392 0.264E-02 0.145E-02
DAV: 5 -0.580827198280E+03 0.25407E-05 -0.22378E-05 3080 0.149E-02
44 F= -.58082720E+03 E0= -.58084163E+03 d E =-.283955E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580828950220E+03 -0.17494E-02 -0.25079E+00 3776 0.388E+00 0.328E-01
DAV: 2 -0.580833714117E+03 -0.47639E-02 -0.54274E-02 4368 0.524E-01 0.157E-01
DAV: 3 -0.580833365636E+03 0.34848E-03 -0.10884E-03 4480 0.923E-02 0.100E-01
DAV: 4 -0.580833157911E+03 0.20773E-03 -0.77448E-04 4616 0.955E-02 0.399E-02
DAV: 5 -0.580833133747E+03 0.24164E-04 -0.29600E-04 4472 0.513E-02 0.311E-02
DAV: 6 -0.580833111987E+03 0.21760E-04 -0.86915E-05 4416 0.302E-02 0.224E-02
DAV: 7 -0.580833090622E+03 0.21365E-04 -0.16290E-05 3048 0.210E-02 0.152E-02
DAV: 8 -0.580833056214E+03 0.34408E-04 -0.53710E-05 4192 0.386E-02 0.135E-02
DAV: 9 -0.580833015671E+03 0.40543E-04 -0.11504E-04 5008 0.563E-02 0.128E-02
DAV: 10 -0.580832984956E+03 0.30715E-04 -0.12250E-04 5200 0.546E-02 0.104E-02
DAV: 11 -0.580832930627E+03 0.54330E-04 -0.12865E-04 4816 0.813E-02 0.126E-02
DAV: 12 -0.580832936063E+03 -0.54366E-05 -0.23202E-04 4440 0.407E-02 0.139E-02
DAV: 13 -0.580832939448E+03 -0.33851E-05 -0.18983E-05 2872 0.974E-03
45 F= -.58083294E+03 E0= -.58085331E+03 d E =-.858071E-02
N E dE d eps ncg rms rms(c)
DAV: 1 -0.580814849295E+03 0.18087E-01 -0.10029E+01 3776 0.776E+00 0.650E-01
DAV: 2 -0.580833877749E+03 -0.19028E-01 -0.21813E-01 4376 0.105E+00 0.323E-01
DAV: 3 -0.580832372161E+03 0.15056E-02 -0.52387E-03 4488 0.195E-01 0.212E-01