N E dE d eps ncg rms rms(c) DAV: 1 0.358125174900E+04 0.35813E+04 -0.25116E+05 4416 0.120E+03 DAV: 2 -0.457193421175E+03 -0.40384E+04 -0.39592E+04 5184 0.326E+02 DAV: 3 -0.745403348637E+03 -0.28821E+03 -0.28709E+03 5568 0.949E+01 DAV: 4 -0.751398490149E+03 -0.59951E+01 -0.59816E+01 6080 0.131E+01 DAV: 5 -0.751713628060E+03 -0.31514E+00 -0.31504E+00 6688 0.198E+00 0.128E+02 DAV: 6 -0.675974373923E+03 0.75739E+02 -0.30496E+02 5024 0.283E+01 0.687E+01 DAV: 7 -0.676409119115E+03 -0.43475E+00 -0.21334E+01 5376 0.751E+00 0.159E+01 DAV: 8 -0.676318546463E+03 0.90573E-01 -0.13166E+00 5632 0.223E+00 0.372E+00 DAV: 9 -0.676347690168E+03 -0.29144E-01 -0.19578E-01 5344 0.984E-01 0.100E+00 DAV: 10 -0.676361483051E+03 -0.13793E-01 -0.43601E-02 5728 0.451E-01 0.513E-01 DAV: 11 -0.676363698839E+03 -0.22158E-02 -0.84254E-03 5344 0.207E-01 0.216E-01 DAV: 12 -0.676363949665E+03 -0.25083E-03 -0.29374E-03 5088 0.136E-01 0.824E-02 DAV: 13 -0.676363902383E+03 0.47282E-04 -0.10631E-03 5344 0.757E-02 0.457E-02 DAV: 14 -0.676363864492E+03 0.37891E-04 -0.27458E-04 4928 0.394E-02 1 F= -.67636386E+03 E0= -.67636386E+03 d E =-.676364E+03 N E dE d eps ncg rms rms(c) DAV: 1 -0.676521868734E+03 -0.15797E+00 -0.45857E+00 5024 0.440E+00 0.355E+00 DAV: 2 -0.676387911321E+03 0.13396E+00 -0.45677E-01 5088 0.124E+00 0.110E+00 DAV: 3 -0.676374821513E+03 0.13090E-01 -0.51389E-02 5632 0.380E-01 0.479E-01 DAV: 4 -0.676373911115E+03 0.91040E-03 -0.59694E-03 5632 0.148E-01 0.256E-01 DAV: 5 -0.676374017000E+03 -0.10588E-03 -0.80668E-04 6336 0.482E-02 0.968E-02 DAV: 6 -0.676374060101E+03 -0.43101E-04 -0.12212E-04 3456 0.217E-02 2 F= -.67637406E+03 E0= -.67637406E+03 d E =-.101956E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676400171742E+03 -0.26155E-01 -0.64268E-01 5024 0.164E+00 0.132E+00 DAV: 2 -0.676381674828E+03 0.18497E-01 -0.63407E-02 5088 0.461E-01 0.421E-01 DAV: 3 -0.676379853739E+03 0.18211E-02 -0.72032E-03 5568 0.142E-01 0.191E-01 DAV: 4 -0.676379681844E+03 0.17190E-03 -0.87008E-04 5632 0.564E-02 0.100E-01 DAV: 5 -0.676379650603E+03 0.31242E-04 -0.96067E-05 3808 0.189E-02 3 F= -.67637965E+03 E0= -.67637965E+03 d E =-.157861E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676456873658E+03 -0.77192E-01 -0.34326E+00 4480 0.367E+00 0.201E+00 DAV: 2 -0.676397065362E+03 0.59808E-01 -0.23888E-01 5376 0.884E-01 0.637E-01 DAV: 3 -0.676390697460E+03 0.63679E-02 -0.18996E-02 5216 0.252E-01 0.261E-01 DAV: 4 -0.676389996873E+03 0.70059E-03 -0.43622E-03 5568 0.122E-01 0.138E-01 DAV: 5 -0.676390023206E+03 -0.26333E-04 -0.31477E-04 5312 0.364E-02 4 F= -.67639002E+03 E0= -.67639002E+03 d E =-.103726E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676391340465E+03 -0.13436E-02 -0.53232E-02 4992 0.455E-01 0.255E-01 DAV: 2 -0.676390471407E+03 0.86906E-03 -0.33043E-03 5376 0.105E-01 0.749E-02 DAV: 3 -0.676390376474E+03 0.94933E-04 -0.38127E-04 4736 0.330E-02 5 F= -.67639038E+03 E0= -.67639038E+03 d E =-.107259E-01 N E dE d eps ncg rms rms(c) DAV: 1 -0.676398499385E+03 -0.80280E-02 -0.16023E+00 4480 0.238E+00 0.106E+00 DAV: 2 -0.676393521040E+03 0.49783E-02 -0.68537E-02 5376 0.457E-01 0.619E-01 DAV: 3 -0.676392058385E+03 0.14627E-02 -0.33818E-03 5376 0.118E-01 0.317E-01 DAV: 4 -0.676391791253E+03 0.26713E-03 -0.16795E-03 5568 0.803E-02 0.983E-02 DAV: 5 -0.676391800073E+03 -0.88196E-05 -0.20034E-04 4480 0.306E-02 6 F= -.67639180E+03 E0= -.67639180E+03 d E =-.142360E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.676394368934E+03 -0.25777E-02 -0.26667E-01 4544 0.973E-01 0.439E-01 DAV: 2 -0.676393435436E+03 0.93350E-03 -0.11114E-02 5376 0.186E-01 0.248E-01 DAV: 3 -0.676393180164E+03 0.25527E-03 -0.64197E-04 5376 0.508E-02 0.122E-01 DAV: 4 -0.676393131998E+03 0.48166E-04 -0.25106E-04 4608 0.318E-02 7 F= -.67639313E+03 E0= -.67639313E+03 d E =-.275552E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.676395215683E+03 -0.20355E-02 -0.40507E-01 4544 0.121E+00 0.283E-01 DAV: 2 -0.676395548527E+03 -0.33284E-03 -0.92072E-03 5344 0.174E-01 0.124E-01 DAV: 3 -0.676395383689E+03 0.16484E-03 -0.31764E-04 4992 0.397E-02 0.642E-02 DAV: 4 -0.676395336957E+03 0.46733E-04 -0.14834E-04 3840 0.286E-02 8 F= -.67639534E+03 E0= -.67639534E+03 d E =-.220496E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.676395942443E+03 -0.55875E-03 -0.36978E-01 4480 0.116E+00 0.276E-01 DAV: 2 -0.676396243968E+03 -0.30153E-03 -0.83489E-03 5344 0.165E-01 0.130E-01 DAV: 3 -0.676396100308E+03 0.14366E-03 -0.27811E-04 4832 0.371E-02 0.676E-02 DAV: 4 -0.676396060046E+03 0.40262E-04 -0.14554E-04 3808 0.289E-02 9 F= -.67639606E+03 E0= -.67639606E+03 d E =-.292805E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.676397142697E+03 -0.10424E-02 -0.63718E-02 4608 0.477E-01 0.868E-02 DAV: 2 -0.676397221133E+03 -0.78436E-04 -0.14422E-03 5056 0.694E-02 0.396E-02 DAV: 3 -0.676397204992E+03 0.16141E-04 -0.44696E-05 2688 0.147E-02 10 F= -.67639720E+03 E0= -.67639720E+03 d E =-.114495E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.676399184359E+03 -0.19632E-02 -0.57340E-01 4352 0.143E+00 0.270E-01 DAV: 2 -0.676399880178E+03 -0.69582E-03 -0.12908E-02 5120 0.207E-01 0.127E-01 DAV: 3 -0.676399723124E+03 0.15705E-03 -0.44656E-04 5248 0.437E-02 0.611E-02 DAV: 4 -0.676399694925E+03 0.28199E-04 -0.96194E-05 3168 0.226E-02 11 F= -.67639969E+03 E0= -.67639969E+03 d E =-.363488E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.676398283689E+03 0.14394E-02 -0.23008E+00 4224 0.287E+00 0.539E-01 DAV: 2 -0.676401158751E+03 -0.28751E-02 -0.52343E-02 5024 0.416E-01 0.251E-01 DAV: 3 -0.676400553547E+03 0.60520E-03 -0.17680E-03 5344 0.872E-02 0.120E-01 DAV: 4 -0.676400443713E+03 0.10983E-03 -0.43328E-04 5216 0.450E-02 0.483E-02 DAV: 5 -0.676400436184E+03 0.75286E-05 -0.58977E-05 3200 0.241E-02 12 F= -.67640044E+03 E0= -.67640044E+03 d E =-.437614E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.676400532964E+03 -0.89251E-04 -0.31170E-01 4288 0.106E+00 0.197E-01 DAV: 2 -0.676400926221E+03 -0.39326E-03 -0.71261E-03 5184 0.154E-01 0.951E-02 DAV: 3 -0.676400843318E+03 0.82903E-04 -0.23732E-04 4064 0.329E-02 13 F= -.67640084E+03 E0= -.67640084E+03 d E =-.478327E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.676402170825E+03 -0.12446E-02 -0.26854E-01 4352 0.983E-01 0.204E-01 DAV: 2 -0.676402600841E+03 -0.43002E-03 -0.61693E-03 5216 0.141E-01 0.810E-02 DAV: 3 -0.676402526459E+03 0.74382E-04 -0.15364E-04 3872 0.285E-02 14 F= -.67640253E+03 E0= -.67640253E+03 d E =-.168314E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.676402620932E+03 -0.20091E-04 -0.58254E-01 4224 0.144E+00 0.313E-01 DAV: 2 -0.676403413959E+03 -0.79303E-03 -0.12605E-02 5280 0.202E-01 0.132E-01 DAV: 3 -0.676403239470E+03 0.17449E-03 -0.40099E-04 5184 0.434E-02 0.712E-02 DAV: 4 -0.676403196616E+03 0.42854E-04 -0.14536E-04 3488 0.296E-02 15 F= -.67640320E+03 E0= -.67640320E+03 d E =-.235330E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.676404470057E+03 -0.12306E-02 -0.39310E-01 4352 0.118E+00 0.185E-01 DAV: 2 -0.676405050524E+03 -0.58047E-03 -0.86636E-03 5024 0.168E-01 0.815E-02 DAV: 3 -0.676404980468E+03 0.70056E-04 -0.19191E-04 4288 0.309E-02 16 F= -.67640498E+03 E0= -.67640498E+03 d E =-.178385E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.676402988843E+03 0.20617E-02 -0.35262E+00 4224 0.354E+00 0.556E-01 DAV: 2 -0.676408086801E+03 -0.50980E-02 -0.77112E-02 5024 0.502E-01 0.252E-01 DAV: 3 -0.676407443162E+03 0.64364E-03 -0.18577E-03 5536 0.922E-02 0.136E-01 DAV: 4 -0.676407286986E+03 0.15618E-03 -0.87945E-04 5216 0.685E-02 0.479E-02 DAV: 5 -0.676407299031E+03 -0.12045E-04 -0.13254E-04 3360 0.272E-02 17 F= -.67640730E+03 E0= -.67640730E+03 d E =-.410242E-02 N E dE d eps ncg rms rms(c) DAV: 1 -0.676408691911E+03 -0.14049E-02 -0.64366E-01 4288 0.150E+00 0.356E-01 DAV: 2 -0.676409830354E+03 -0.11384E-02 -0.16745E-02 5248 0.232E-01 0.183E-01 DAV: 3 -0.676409688716E+03 0.14164E-03 -0.41081E-04 5152 0.459E-02 0.927E-02 DAV: 4 -0.676409671226E+03 0.17490E-04 -0.19842E-04 4032 0.300E-02 18 F= -.67640967E+03 E0= -.67640967E+03 d E =-.237220E-02