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Sorry, I found the right one :)

Dmitry Ryndyk
dmitry.ryndyk@mail.ru


Well, I found the right Hessian below in the PUNCH file.
It was simply too big. :)

Dmitry

$HESS
ENERGY IS  -172943.5893315584 E(NUC) IS    33283.9128206879
1  1 3.43760946E-01 4.70552980E-01 1.28351481E-01 5.36886073E-01-4.22718101E-02
1  2 1.52317667E-01 8.16173938E-02 4.23751648E-01 1.61934083E-01-2.48487628E-01
1  3-1.48997770E-01-1.02083578E-01 2.32513883E-01 2.55733517E-01 2.24703830E-01
1  4 2.55340615E-01 1.43474057E-02 1.58902957E-01 2.50871147E-02 2.55522067E-01
1  5 2.34499884E-01 3.26582673E-03 1.88535871E-02 1.98936745E-01 1.45968068E-01
1  6 1.37772288E-01 1.28702902E-01 1.46793747E-01 1.46892640E-01 1.46767046E-01
1  7 1.45216777E-01 1.45338381E-01 1.45076176E-01 1.46956264E-01 1.47064888E-01
1  8 1.47097646E-01 1.49958740E-01 1.48363859E-01 1.46791549E-01
2  1 4.70552980E-01 6.77865297E-01 2.94526318E-01 7.02589633E-01 7.85904159E-02
2  2 3.27318480E-01 2.88946765E-01 5.86325972E-01 3.18801370E-01-7.94788993E-02
2  3 1.26955472E-02 6.24428537E-02 3.96292650E-01 4.21674734E-01 3.89563789E-01
2  4 4.21003291E-01 1.80254608E-01 3.23569108E-01 1.88925544E-01 4.19617081E-01
2  5 3.99587998E-01 1.68909414E-01 1.82972834E-01 3.63816405E-01 3.01229276E-01
2  6 3.09406549E-01 2.91312574E-01 3.12102181E-01 3.11407431E-01 3.11614134E-01
2  7 3.11298391E-01 3.08470205E-01 3.09656683E-01 3.11627064E-01 3.12243991E-01
2  8 3.11843783E-01 3.13388958E-01 3.15200370E-01 3.11104960E-01
3  1 1.28351481E-01 2.94526318E-01-4.57856040E-02 3.62939428E-01-2.22266569E-01
3  2-2.00919948E-02-5.63485768E-02 2.49474625E-01-1.94113635E-02-4.20117948E-01
3  3-3.24211809E-01-2.81219813E-01 5.57549854E-02 7.99539494E-02 4.82054264E-02
3  4 7.94224630E-02-1.61508657E-01-1.75450183E-02-1.51696652E-01 7.88047214E-02
3  5 5.82404460E-02-1.72763799E-01-1.57859718E-01 2.27977318E-02-3.69673278E-02
3  6-3.87860050E-02-4.24792407E-02-2.92936198E-02-2.94887525E-02-2.86633363E-02
3  7-2.74325250E-02-2.25184548E-02-1.93543869E-02-2.97370708E-02-2.93522624E-02
3  8-3.03110789E-02-3.04153753E-02-3.63731676E-02-4.50686833E-02
4  1 5.36886073E-01 7.02589633E-01 3.62939428E-01 8.50345052E-01 1.87749448E-01
4  2 4.20922063E-01 3.64767960E-01 6.75211438E-01 4.06277047E-01-4.06132479E-02
4  3 1.00827911E-01 1.43305448E-01 4.78001664E-01 5.02918692E-01 4.70946361E-01
4  4 5.02569860E-01 2.61549803E-01 4.05145012E-01 2.70590551E-01 5.00970090E-01
4  5 4.80847606E-01 2.50480224E-01 2.64313960E-01 4.45293781E-01 3.79277167E-01
4  6 4.05685460E-01 3.66176331E-01 3.93210942E-01 3.93107345E-01 3.93123568E-01
4  7 3.93039649E-01 3.93105380E-01 3.92552093E-01 3.92965097E-01 3.93554118E-01
4  8 3.93021232E-01 3.95205639E-01 3.93075356E-01 3.93204592E-01
...............................................................................


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