non-spherical Matrixelements x Gaunt-Coefficient (d=du/dE): l0 ll lp m0 mm mp uVu dVd uVd dVu 1 .Atom 0 4 4 0 0 0 0.527286872227E-02 0.000000000000E+00 0.553166751825E-04 0.000000000000E+00 0.104051129002E-04 0.000000000000E+00 0.106201097409E-02 0.000000000000E+00 -0.366268353335E-02 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 -0.207656553643E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0 4 4 0 4 -4 0.315114177506E-02 0.000000000000E+00 0.330580363757E-04 0.000000000000E+00 0.621824431082E-05 0.000000000000E+00 0.634672949831E-03 0.000000000000E+00 -0.218887207300E-02 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 -0.124098526915E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0 4 4 0 4 4 0.315114177506E-02 0.000000000000E+00 0.330580363757E-04 0.000000000000E+00 0.621824431082E-05 0.000000000000E+00 0.634672949831E-03 0.000000000000E+00 -0.218887207300E-02 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 -0.124098526915E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 1 4 3 -1 0 -1 0.248977079098E-02 0.000000000000E+00 0.729766706407E-03 0.000000000000E+00 -0.125738364811E-02 0.000000000000E+00-0.398191640313E-03 0.000000000000E+00 0.197777908786E-02 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 -0.519350250028E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 1 4 3 0 0 0-0.406577867626E-02 0.000000000000E+00-0.119170404131E-02 0.000000000000E+00 0.205329889919E-02 0.000000000000E+00 0.650244225740E-03 0.000000000000E+00 -0.322969972613E-02 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.848095406904E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 1 4 3 1 0 1 0.248977079098E-02 0.000000000000E+00 0.729766706407E-03 0.000000000000E+00 -0.125738364811E-02 0.000000000000E+00-0.398191640313E-03 0.000000000000E+00 0.197777908786E-02 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 -0.519350250028E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 1 4 3 1 4 -3 0.321428026979E-02 0.000000000000E+00 0.942124766843E-03 0.000000000000E+00 -0.162327530964E-02 0.000000000000E+00-0.514063197178E-03 0.000000000000E+00 0.255330182325E-02 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 -0.670478289736E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 1 4 3 -1 4 3 0.321428026979E-02 0.000000000000E+00 0.942124766843E-03 0.000000000000E+00 -0.162327530964E-02 0.000000000000E+00-0.514063197178E-03 0.000000000000E+00 0.255330182325E-02 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 -0.670478289736E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 2 -2 0 -2 0.107475862338E-02 0.000000000000E+00 0.151188613445E-04 0.000000000000E+00 -0.104151621239E-04 0.000000000000E+00-0.104151621239E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 2 -1 0 -1-0.429903449351E-02 0.000000000000E+00-0.604754453779E-04 0.000000000000E+00 0.416606484955E-04 0.000000000000E+00 0.416606484955E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 2 0 0 0 0.644855174027E-02 0.000000000000E+00 0.907131680669E-04 0.000000000000E+00 -0.624909727433E-04 0.000000000000E+00-0.624909727433E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 2 1 0 1-0.429903449351E-02 0.000000000000E+00-0.604754453779E-04 0.000000000000E+00 0.416606484955E-04 0.000000000000E+00 0.416606484955E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 2 2 0 2 0.107475862338E-02 0.000000000000E+00 0.151188613445E-04 0.000000000000E+00 -0.104151621239E-04 0.000000000000E+00-0.104151621239E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 2 2 4 -2 0.537379311689E-02 0.000000000000E+00 0.755943067224E-04 0.000000000000E+00 -0.520758106194E-04 0.000000000000E+00-0.520758106194E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 2 -2 4 2 0.537379311689E-02 0.000000000000E+00 0.755943067224E-04 0.000000000000E+00 -0.520758106194E-04 0.000000000000E+00-0.520758106194E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 4 -2 0 -2 0.476651025350E-02 0.000000000000E+00 0.195418738467E-04 0.000000000000E+00 0.140703423665E-03 0.000000000000E+00-0.207611658668E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 4 -1 0 -1-0.112347724095E-02 0.000000000000E+00-0.460606383804E-05 0.000000000000E+00 -0.331641150033E-04 0.000000000000E+00 0.489345372324E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 4 0 0 0-0.410235885140E-02 0.000000000000E+00-0.168189671027E-04 0.000000000000E+00 -0.121098225913E-03 0.000000000000E+00 0.178683665889E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 4 1 0 1-0.112347724095E-02 0.000000000000E+00-0.460606383804E-05 0.000000000000E+00 -0.331641150033E-04 0.000000000000E+00 0.489345372324E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 4 2 0 2 0.476651025350E-02 0.000000000000E+00 0.195418738467E-04 0.000000000000E+00 0.140703423665E-03 0.000000000000E+00-0.207611658668E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 4 0 4 -4 0.343227966547E-02 0.000000000000E+00 0.140717574624E-04 0.000000000000E+00 0.101318044906E-03 0.000000000000E+00-0.149497480643E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 4 1 4 -3 0.297244138319E-02 0.000000000000E+00 0.121864994383E-04 0.000000000000E+00 0.877440007502E-04 0.000000000000E+00-0.129468616039E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 4 2 4 -2 0.158883675117E-02 0.000000000000E+00 0.651395794891E-05 0.000000000000E+00 0.469011412217E-04 0.000000000000E+00-0.692038862225E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 4 -2 4 2 0.158883675117E-02 0.000000000000E+00 0.651395794891E-05 0.000000000000E+00 0.469011412217E-04 0.000000000000E+00-0.692038862225E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 4 -1 4 3 0.297244138319E-02 0.000000000000E+00 0.121864994383E-04 0.000000000000E+00 0.877440007502E-04 0.000000000000E+00-0.129468616039E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 4 4 0 4 4 0.343227966547E-02 0.000000000000E+00 0.140717574624E-04 0.000000000000E+00 0.101318044906E-03 0.000000000000E+00-0.149497480643E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 6 4 -2 0 -2 0.124151001404E-04 0.000000000000E+00 0.639353635349E-06 0.000000000000E+00 -0.466562478890E-05 0.000000000000E+00-0.125423349809E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 6 4 -1 0 -1-0.351152059937E-04 0.000000000000E+00-0.180836516453E-05 0.000000000000E+00 0.131963797068E-04 0.000000000000E+00 0.354750804675E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 6 4 0 0 0 0.480834760854E-04 0.000000000000E+00 0.247620598204E-05 0.000000000000E+00 -0.180698871071E-04 0.000000000000E+00-0.485762545035E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 6 4 1 0 1-0.351152059937E-04 0.000000000000E+00-0.180836516453E-05 0.000000000000E+00 0.131963797068E-04 0.000000000000E+00 0.354750804675E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 6 4 2 0 2 0.124151001404E-04 0.000000000000E+00 0.639353635349E-06 0.000000000000E+00 -0.466562478890E-05 0.000000000000E+00-0.125423349809E-04 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0.000000000000E+00 0.326593735223E-04 0.000000000000E+00 0.877963448661E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 6 4 -2 4 2-0.869057009831E-04 0.000000000000E+00-0.447547544744E-05 0.000000000000E+00 0.326593735223E-04 0.000000000000E+00 0.877963448661E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 6 4 -1 4 3 0.929061022960E-04 0.000000000000E+00 0.478448450493E-05 0.000000000000E+00 -0.349143389106E-04 0.000000000000E+00-0.938582406571E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 2 6 4 0 4 4-0.402295223775E-04 0.000000000000E+00-0.207174256264E-05 0.000000000000E+00 0.151183522265E-04 0.000000000000E+00 0.406418103818E-04 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 3 4 1 -1 0 -1 0.248977079098E-02 0.000000000000E+00 0.729766706407E-03 0.000000000000E+00 -0.398191640313E-03 0.000000000000E+00-0.125738364811E-02 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.197777908786E-02 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00-0.519350250028E-03 0.000000000000E+00 3 4 1 0 0 0-0.406577867626E-02 0.000000000000E+00-0.119170404131E-02 0.000000000000E+00 0.650244225740E-03 0.000000000000E+00 0.205329889919E-02 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00-0.322969972613E-02 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 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0.255330182325E-02 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00-0.670478289736E-03 0.000000000000E+00 3 4 3 -3 0 -3 0.107337777661E-02 0.000000000000E+00 0.745049642160E-03 0.000000000000E+00 -0.566539253879E-03 0.000000000000E+00-0.566539253879E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 3 4 3 -2 0 -2-0.250454814543E-02 0.000000000000E+00-0.173844916504E-02 0.000000000000E+00 0.132192492572E-02 0.000000000000E+00 0.132192492572E-02 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 3 4 3 -1 0 -1 0.357792592205E-03 0.000000000000E+00 0.248349880720E-03 0.000000000000E+00 -0.188846417960E-03 0.000000000000E+00-0.188846417960E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 3 4 3 0 0 0 0.214675555323E-02 0.000000000000E+00 0.149009928432E-02 0.000000000000E+00 -0.113307850776E-02 0.000000000000E+00-0.113307850776E-02 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 3 4 3 1 0 1 0.357792592205E-03 0.000000000000E+00 0.248349880720E-03 0.000000000000E+00 -0.188846417960E-03 0.000000000000E+00-0.188846417960E-03 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 0.000000000000E+00 3 4 3 2 0 2-0.250454814543E-02 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