N E dE d eps ncg rms ort DAV: 1 0.792953060612E+03 0.79295E+03 -0.24001E+04 2150 0.955E+02 DAV: 2 0.160305404145E+03 -0.63265E+03 -0.60892E+03 2150 0.315E+02 DAV: 3 0.609392350768E+00 -0.15970E+03 -0.15707E+03 2150 0.167E+02 DAV: 4 -0.269293279996E+02 -0.27539E+02 -0.27330E+02 2150 0.691E+01 DAV: 5 -0.308876403011E+02 -0.39583E+01 -0.39144E+01 2150 0.236E+01 SDA: 6 -0.308639567494E+02 0.23684E-01 -0.82956E+00 2150 0.207E+01 0.000E+00 DMP: 7 -0.314636551515E+02 -0.59970E+00 -0.36770E+00 2150 0.567E+00 0.922E+00 DMP: 8 -0.316948202535E+02 -0.23117E+00 -0.94342E-01 2150 0.149E+00 0.226E+00 DMP: 9 -0.317501025637E+02 -0.55282E-01 -0.35436E-01 2150 0.766E-01 0.315E-01 DMP: 10 -0.317755691830E+02 -0.25467E-01 -0.21853E-01 2150 0.414E-01 0.347E-01 DMP: 11 -0.317914043074E+02 -0.15835E-01 -0.93102E-02 2150 0.145E-01 0.231E-01 DMP: 12 -0.317979218105E+02 -0.65175E-02 -0.34829E-02 2150 0.534E-02 0.883E-02 DMP: 13 -0.318003505011E+02 -0.24287E-02 -0.13205E-02 2150 0.204E-02 0.330E-02 DMP: 14 -0.318012767027E+02 -0.92620E-03 -0.52059E-03 2150 0.804E-03 0.130E-02 DMP: 15 -0.318016425409E+02 -0.36584E-03 -0.21483E-03 2150 0.337E-03 0.524E-03 DMP: 16 -0.318018005475E+02 -0.15801E-03 -0.94613E-04 2150 0.142E-03 0.248E-03 DMP: 17 -0.318018696999E+02 -0.69152E-04 -0.36182E-04 2150 0.509E-04 0.104E-03 DMP: 18 -0.318018962647E+02 -0.26565E-04 -0.14961E-04 2150 0.220E-04 0.405E-04 DMP: 19 -0.318019071456E+02 -0.10881E-04 -0.64627E-05 2150 0.931E-05 0.179E-04 DMP: 20 -0.318019118391E+02 -0.46935E-05 -0.28829E-05 2150 0.408E-05 0.820E-05 1 F= -.31801912E+02 E0= -.31803112E+02 d E =0.360028E-02