mirror of https://gitlab.com/QEF/q-e.git
21399 lines
1.6 MiB
21399 lines
1.6 MiB
<PP_INFO>
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Generated using "atomic" code by A. Dal Corso (espresso distribution)
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Author: anonymous Generation date: 2Sep2007
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Ni
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2 The Pseudo was generated with a Fully-Relativistic Calculation
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-1 1.7000000E+00 L component and cutoff radius for Local Potential
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nl pn l occ Rcut Rcut US E pseu
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4S 1 0 1.00 2.00000000000 2.50000000000 -0.33011621065
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4S 1 0 0.00 2.00000000000 2.50000000000 0.10000000000
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4P 2 1 0.00 2.40000000000 2.60000000000 -0.05696910468
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4P 2 1 0.00 2.40000000000 2.60000000000 0.30000000000
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4P 2 1 0.00 2.40000000000 2.60000000000 -0.05454257888
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4P 2 1 0.00 2.40000000000 2.60000000000 0.30000000000
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3D 3 2 4.00 1.60000000000 2.50000000000 -0.35045629533
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3D 3 2 0.00 1.60000000000 2.50000000000 -0.25000000000
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3D 3 2 5.00 1.60000000000 2.50000000000 -0.33442538620
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3D 3 2 0.00 1.60000000000 2.50000000000 -0.25000000000
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</PP_INFO>
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<PP_HEADER>
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0 Version Number
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Ni Element
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US Ultrasoft pseudopotential
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T Nonlinear Core Correction
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SLA PW PBX PBC PBE Exchange-Correlation functional
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10.00000000000 Z valence
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-90.30524855311 Total energy
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23.557 371.902 Suggested cutoff for wfc and rho
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2 Max angular momentum component
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1195 Number of points in mesh
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3 10 Number of Wavefunctions, Number of Projectors
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Wavefunctions nl l occ
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3D 2 4.00
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3D 2 5.00
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4S 0 1.00
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</PP_HEADER>
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<PP_MESH>
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<PP_R>
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</PP_LOCAL>
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<PP_NONLOCAL>
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<PP_BETA>
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1 0 Beta L
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911
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2.00 2.50
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|
4S
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|
</PP_BETA>
|
|
<PP_BETA>
|
|
2 0 Beta L
|
|
911
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2.00 2.50
|
|
4S
|
|
</PP_BETA>
|
|
<PP_BETA>
|
|
3 1 Beta L
|
|
915
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2.40529316137E+01 1.92916675433E+01 1.37414267796E+01 7.23955026825E+00
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7.97281934389E-01 -7.51973710434E-02 1.11193300240E-02 2.37654446955E-03
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3.05790953889E-03 2.80465055003E-03 2.64395986281E-03 2.47415551537E-03
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2.30552104470E-03 2.13721738831E-03 1.96953033060E-03
|
|
2.40 2.60
|
|
4P
|
|
</PP_BETA>
|
|
<PP_BETA>
|
|
4 1 Beta L
|
|
915
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2.40 2.60
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4P
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|
</PP_BETA>
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|
<PP_BETA>
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5 1 Beta L
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915
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4.09070835585E+01 4.06988920660E+01 4.00598265021E+01 3.89483097867E+01
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3.73209352440E+01 3.51325488861E+01 3.23363573057E+01 2.88840448061E+01
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2.47260833479E+01 1.98104777651E+01 1.40970482594E+01 7.42112955427E+00
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8.20594425887E-01 -7.31329084250E-02 1.52494949369E-02 6.26064132076E-03
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6.92478791090E-03 6.63127545824E-03 6.43224861245E-03 6.22355087590E-03
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6.01568047294E-03 5.80774340349E-03 5.60000401715E-03
|
|
2.40 2.60
|
|
4P
|
|
</PP_BETA>
|
|
<PP_BETA>
|
|
6 1 Beta L
|
|
915
|
|
1.43053493563E-07 1.46674909990E-07 1.50388003010E-07 1.54195093427E-07
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1.93102018162E-07 1.97990419018E-07 2.03002570330E-07 2.08141604856E-07
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2.13410734659E-07 2.18813253119E-07 2.24352536984E-07 2.30032048487E-07
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2.35855337508E-07 2.41826043791E-07 2.47947899223E-07 2.54224730163E-07
|
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2.88074359636E-07 2.95366996752E-07 3.02844247856E-07 3.10510786471E-07
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3.18371404434E-07 3.26431014887E-07 3.34694655349E-07 3.43167490865E-07
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3.51854817231E-07 3.60762064310E-07 3.69894799421E-07 3.79258730821E-07
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4.74954323550E-07 4.86977849446E-07 4.99305752347E-07 5.11945737594E-07
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5.24905705587E-07 5.38193756730E-07 5.51818196485E-07 5.65787540572E-07
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2.40 2.60
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4P
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|
</PP_BETA>
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<PP_BETA>
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7 2 Beta L
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911
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1.60 2.50
|
|
3D
|
|
</PP_BETA>
|
|
<PP_BETA>
|
|
8 2 Beta L
|
|
911
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1.08627892138E-08 1.12778782925E-08 1.17088287673E-08 1.21562467348E-08
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1.60 2.50
|
|
3D
|
|
</PP_BETA>
|
|
<PP_BETA>
|
|
9 2 Beta L
|
|
911
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|
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|
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1.60 2.50
|
|
3D
|
|
</PP_BETA>
|
|
<PP_BETA>
|
|
10 2 Beta L
|
|
911
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1.95118775467E-12 2.02574653553E-12 2.10315435631E-12 2.18352008451E-12
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|
|
1.16224828611E-05 1.20665864411E-05 1.25276599817E-05 1.30063589900E-05
|
|
1.35033458984E-05 1.40193242164E-05 1.45550172950E-05 1.51111803430E-05
|
|
1.56885993188E-05 1.62880723483E-05 1.69104638012E-05 1.75566212322E-05
|
|
1.82274872459E-05 1.89239792437E-05 1.96470823128E-05 2.03978252639E-05
|
|
2.11772556773E-05 2.19864510395E-05 2.28265878559E-05 2.36988079860E-05
|
|
2.46043691618E-05 2.55445275148E-05 2.65206101446E-05 2.75339979174E-05
|
|
2.85861054305E-05 2.96784167204E-05 3.08124516720E-05 3.19898350722E-05
|
|
3.32122003645E-05 3.44812720397E-05 3.57988387077E-05 3.71667552251E-05
|
|
3.85869301211E-05 4.00613842404E-05 4.15921695221E-05 4.31814574091E-05
|
|
4.48314597728E-05 4.65445092804E-05 4.83230315807E-05 5.01694943592E-05
|
|
5.20865206944E-05 5.40768041423E-05 5.61431221624E-05 5.82884081021E-05
|
|
6.05156584323E-05 6.28280094186E-05 6.52287271912E-05 6.77211877878E-05
|
|
7.03088599170E-05 7.29954238824E-05 7.57846373813E-05 7.86804267227E-05
|
|
8.16868615776E-05 8.48081823767E-05 8.80487523651E-05 9.14131715596E-05
|
|
9.49061307956E-05 9.85325487522E-05 1.02297538533E-04 1.06206377340E-04
|
|
1.10264604900E-04 1.14477867857E-04 1.18852121852E-04 1.23393525724E-04
|
|
1.28108435745E-04 1.33003491609E-04 1.38085625608E-04 1.43361917030E-04
|
|
1.48839817434E-04 1.54527071855E-04 1.60431008498E-04 1.66566939235E-04
|
|
1.72874742782E-04 1.80031736240E-04 1.81553469022E-04 1.92126762144E-04
|
|
2.13005412149E-04 2.00163612939E-04 2.26357289188E-04 2.15013021392E-04
|
|
2.28027971315E-04 2.43548911207E-04 2.77974122697E-04 2.36586065774E-04
|
|
2.70990536404E-04 2.89057995862E-04 2.95760495855E-04 3.01525123006E-04
|
|
2.98648178916E-04 3.42893270525E-04 3.39426182577E-04 3.54140198738E-04
|
|
3.59062998255E-04 3.75804845213E-04 4.06423301004E-04 3.96399403412E-04
|
|
4.35088510002E-04 4.43566867442E-04 4.56055708194E-04 4.67016703571E-04
|
|
5.06560083598E-04 5.01941454668E-04 5.38794582519E-04 5.50295199277E-04
|
|
5.82991281608E-04 5.81136457938E-04 6.40426153751E-04 6.19774447848E-04
|
|
6.80292348075E-04 6.86105621976E-04 7.22137283092E-04 7.46999858698E-04
|
|
7.63713938093E-04 8.09204918163E-04 8.53925790215E-04 8.53715661874E-04
|
|
9.00550785345E-04 9.30409708215E-04 9.66880754024E-04 1.02676128678E-03
|
|
1.02987318835E-03 1.09220486373E-03 1.12726773143E-03 1.16633437780E-03
|
|
1.21388949904E-03 1.27284841970E-03 1.29833485652E-03 1.35719460319E-03
|
|
1.43650075127E-03 1.44799245042E-03 1.51524517944E-03 1.57895301251E-03
|
|
1.65113519682E-03 1.70154368472E-03 1.76690487959E-03 1.82443095111E-03
|
|
1.91933348172E-03 1.97812227253E-03 2.05444654606E-03 2.12391449647E-03
|
|
2.22142156156E-03 2.30553201531E-03 2.37132005229E-03 2.47604121165E-03
|
|
2.58277992242E-03 2.66388162696E-03 2.77677713639E-03 2.87779602806E-03
|
|
2.99623569631E-03 3.08617152096E-03 3.23169519669E-03 3.34039406688E-03
|
|
3.47492372767E-03 3.59603930801E-03 3.74827013229E-03 3.88386051127E-03
|
|
4.04227756318E-03 4.17108057264E-03 4.36445893370E-03 4.49912389517E-03
|
|
4.69236385880E-03 4.86210820596E-03 5.05439309620E-03 5.24287831192E-03
|
|
5.44441292284E-03 5.65055354064E-03 5.86665021733E-03 6.09444416893E-03
|
|
6.32207994491E-03 6.56677268112E-03 6.82026627138E-03 7.06870625726E-03
|
|
7.35418738231E-03 7.62785583008E-03 7.91432091917E-03 8.22585712004E-03
|
|
8.53489667817E-03 8.86120174749E-03 9.20038462311E-03 9.55036742752E-03
|
|
9.91635067329E-03 1.02950664079E-02 1.06888630436E-02 1.10940071209E-02
|
|
1.15209195593E-02 1.19590904463E-02 1.24172551110E-02 1.28878580113E-02
|
|
1.33839237845E-02 1.38910602643E-02 1.44274245968E-02 1.49702333294E-02
|
|
1.55491644270E-02 1.61370686691E-02 1.67575681449E-02 1.73935337366E-02
|
|
1.80585136403E-02 1.87494846017E-02 1.94642633642E-02 2.02070682200E-02
|
|
2.09785275458E-02 2.17783179153E-02 2.26111175646E-02 2.34732415052E-02
|
|
2.43677154758E-02 2.52991292986E-02 2.62649822645E-02 2.72676801346E-02
|
|
2.83060334006E-02 2.93868933733E-02 3.05105204666E-02 3.16697924526E-02
|
|
3.28823222377E-02 3.41359293688E-02 3.54366847919E-02 3.67905983983E-02
|
|
3.81926100883E-02 3.96494641953E-02 4.11628499382E-02 4.27317562940E-02
|
|
4.43621010523E-02 4.60539487991E-02 4.78096188972E-02 4.96336765023E-02
|
|
5.15253642412E-02 5.34909386946E-02 5.55297111035E-02 5.76472401481E-02
|
|
5.98441277214E-02 6.21262704412E-02 6.44941985799E-02 6.69520261004E-02
|
|
6.95041059626E-02 7.21529968008E-02 7.49022391454E-02 7.77567597966E-02
|
|
8.07186516300E-02 8.37950197528E-02 8.69866902497E-02 9.03003958415E-02
|
|
9.37395005125E-02 9.73105418549E-02 1.01015797379E-01 1.04862683266E-01
|
|
1.08855420516E-01 1.12999853230E-01 1.17301445980E-01 1.21766812705E-01
|
|
1.26401266790E-01 1.31211944900E-01 1.36204400652E-01 1.41387011603E-01
|
|
1.46766153511E-01 1.52349015397E-01 1.58143477574E-01 1.64157748957E-01
|
|
1.70399891835E-01 1.76878524450E-01 1.83602466884E-01 1.90581292258E-01
|
|
1.97823907178E-01 2.05341032292E-01 2.13142472908E-01 2.21238729837E-01
|
|
2.29641647106E-01 2.38362029199E-01 2.47411912197E-01 2.56803730610E-01
|
|
2.66550480298E-01 2.76664865695E-01 2.87161410252E-01 2.98053797408E-01
|
|
3.09357002216E-01 3.21086351733E-01 3.33257919177E-01 3.45887824233E-01
|
|
3.58993371375E-01 3.72592406719E-01 3.86702753203E-01 4.01344042446E-01
|
|
4.16535568091E-01 4.32297806181E-01 4.48652013863E-01 4.65619978114E-01
|
|
4.83224448239E-01 5.01488835154E-01 5.20437731040E-01 5.40096121138E-01
|
|
5.60490174029E-01 5.81646947819E-01 6.03594540122E-01 6.26361747858E-01
|
|
6.49978792686E-01 6.74476625799E-01 6.99887483890E-01 7.26244541035E-01
|
|
7.53582342435E-01 7.81936536077E-01 8.11343878885E-01 8.41842680997E-01
|
|
8.73472249564E-01 9.06273437506E-01 9.40288530134E-01 9.75560905291E-01
|
|
1.01213591592E+00 1.05006000258E+00 1.08938139956E+00 1.13014980861E+00
|
|
1.17241669226E+00 1.21623502573E+00 1.26165976578E+00 1.30874737916E+00
|
|
1.35755637473E+00 1.40814698515E+00 1.46058137263E+00 1.51492372438E+00
|
|
1.57124014940E+00 1.62959887429E+00 1.69007011772E+00 1.75272627376E+00
|
|
1.81764199766E+00 1.88489394213E+00 1.95456120537E+00 2.02672506414E+00
|
|
2.10146915828E+00 2.17887942899E+00 2.25904428738E+00 2.34205438100E+00
|
|
2.42800301041E+00 2.51698567427E+00 2.60910057000E+00 2.70444814630E+00
|
|
2.80313144851E+00 2.90525597490E+00 3.01092957941E+00 3.12026270223E+00
|
|
3.23336805788E+00 3.35036078578E+00 3.47135837538E+00 3.59648050634E+00
|
|
3.72584913225E+00 3.85958827627E+00 3.99782399614E+00 4.14068421764E+00
|
|
4.28829869188E+00 4.44079875707E+00 4.59831720212E+00 4.76098810970E+00
|
|
4.92894659532E+00 5.10232859905E+00 5.28127059217E+00 5.46590932920E+00
|
|
5.65638149832E+00 5.85282334251E+00 6.05537030552E+00 6.26415659259E+00
|
|
6.47931469319E+00 6.70097486153E+00 6.92926459597E+00 7.16430798140E+00
|
|
7.40622507003E+00 7.65513117997E+00 7.91113608135E+00 8.17434321567E+00
|
|
8.44484878236E+00 8.72274079539E+00 9.00809803511E+00 9.30098897207E+00
|
|
9.60147058648E+00 9.90958709631E+00 1.02253686423E+01 1.05488298422E+01
|
|
1.08799683195E+01 1.12187630297E+01 1.15651726522E+01 1.19191337198E+01
|
|
1.22805587823E+01 1.26493343876E+01 1.30253190188E+01 1.34083408756E+01
|
|
1.37981956151E+01 1.41946439561E+01 1.45974091806E+01 1.50061745877E+01
|
|
1.54205808019E+01 1.58402230374E+01 1.62646482682E+01 1.66933523294E+01
|
|
1.71257769721E+01 1.75613068521E+01 1.79992664999E+01 1.84389172765E+01
|
|
1.88794543132E+01 1.93200034970E+01 1.97596184885E+01 2.01972778200E+01
|
|
2.06318820998E+01 2.10622513514E+01 2.14871225348E+01 2.19051472838E+01
|
|
2.23148899047E+01 2.27148256945E+01 2.31033396142E+01 2.34787254055E+01
|
|
2.38391851791E+01 2.41828295633E+01 2.45076784876E+01 2.48116626514E+01
|
|
2.50926257955E+01 2.53483278216E+01 2.55764488760E+01 2.57745944720E+01
|
|
2.59403017491E+01 2.60710469633E+01 2.61642542997E+01 2.62173061028E+01
|
|
2.62275546289E+01 2.61923353855E+01 2.61089821755E+01 2.59748438902E+01
|
|
2.57873031572E+01 2.55437968725E+01 2.52418386836E+01 2.48790434450E+01
|
|
2.44531536567E+01 2.39620678785E+01 2.34038710870E+01 2.27768668944E+01
|
|
2.20796115475E+01 2.13109495593E+01 2.04700507954E+01 1.95564488014E+01
|
|
1.85700800879E+01 1.75113240513E+01 1.63810431513E+01 1.51806228959E+01
|
|
1.39120111298E+01 1.25777560506E+01 1.11810423115E+01 9.72572449995E+00
|
|
8.21635720458E+00 6.65822082802E+00 5.05734220990E+00 3.42050910279E+00
|
|
1.75527741600E+00 6.99701726909E-02 -1.62633299089E+00 -3.32381697075E+00
|
|
-5.01196416457E+00 -6.67960050896E+00 -8.31495579032E+00 -9.90573941475E+00
|
|
-1.14392328098E+01 -1.29023995260E+01 -1.42820140671E+01 -1.55648918556E+01
|
|
-1.67382296189E+01 -1.77894645307E+01 -1.87063681937E+01 -1.94772388956E+01
|
|
-2.00911140335E+01 -2.05380027723E+01 -2.08091386442E+01 -2.08972514282E+01
|
|
-2.07968572316E+01 -2.05045651658E+01 -2.00193984812E+01 -1.93431273862E+01
|
|
-1.84806100550E+01 -1.74401376119E+01 -1.62337779861E+01 -1.48777126762E+01
|
|
-1.33925594859E+01 -1.18036732744E+01 -1.01414157580E+01 -8.44138427579E+00
|
|
-6.74458843279E+00 -5.09756245981E+00 -3.55239999364E+00 -2.16669896223E+00
|
|
-1.00338524197E+00 -1.30560740357E-01 3.80203637029E-01 4.41952270985E-01
|
|
7.44282978033E-02 -7.33387634766E-03 7.70201147450E-04 -3.52096978513E-05
|
|
4.29002956195E-05 3.35982051915E-05 3.31326923246E-05 3.19472468199E-05
|
|
3.09770771198E-05 3.01166932431E-05 2.93645028397E-05
|
|
1.60 2.50
|
|
3D
|
|
</PP_BETA>
|
|
<PP_DIJ>
|
|
15 Number of nonzero Dij
|
|
1 1 3.29618166167E-01
|
|
1 2 -3.03805162315E-01
|
|
2 2 2.80458726174E-01
|
|
3 3 4.32548359392E-02
|
|
3 4 6.45149604853E-02
|
|
4 4 9.63167798653E-02
|
|
5 5 4.28615146570E-02
|
|
5 6 6.50910333788E-02
|
|
6 6 9.88863495494E-02
|
|
7 7 3.70139988037E+00
|
|
7 8 4.12413793960E+00
|
|
8 8 4.58989063133E+00
|
|
9 9 3.67374243695E+00
|
|
9 10 3.98431632453E+00
|
|
10 10 4.31951278681E+00
|
|
</PP_DIJ>
|
|
<PP_QIJ>
|
|
0 nqf. If not zero, Qij's inside rinner are computed using qfcoef's
|
|
1 1 0 i j (l(j))
|
|
-1.19402001602E-01 Q_int
|
|
7.27289262262E-11 7.45700677261E-11 7.64578179433E-11 7.83933567829E-11
|
|
8.03778940197E-11 8.24126700538E-11 8.44989566864E-11 8.66380579144E-11
|
|
8.88313107455E-11 9.10800860339E-11 9.33857893373E-11 9.57498617950E-11
|
|
9.81737810291E-11 1.00659062068E-10 1.03207258292E-10 1.05819962408E-10
|
|
1.08498807440E-10 1.11245467754E-10 1.14061660100E-10 1.16949144691E-10
|
|
1.19909726299E-10 1.22945255382E-10 1.26057629245E-10 1.29248793223E-10
|
|
1.32520741896E-10 1.35875520340E-10 1.39315225398E-10 1.42842006998E-10
|
|
1.46458069493E-10 1.50165673040E-10 1.53967135010E-10 1.57864831441E-10
|
|
1.61861198520E-10 1.65958734104E-10 1.70159999288E-10 1.74467619997E-10
|
|
1.78884288634E-10 1.83412765760E-10 1.88055881820E-10 1.92816538912E-10
|
|
1.97697712601E-10 2.02702453778E-10 2.07833890568E-10 2.13095230287E-10
|
|
2.18489761440E-10 2.24020855785E-10 2.29691970435E-10 2.35506650019E-10
|
|
2.41468528902E-10 2.47581333448E-10 2.53848884360E-10 2.60275099059E-10
|
|
2.66863994137E-10 2.73619687866E-10 2.80546402773E-10 2.87648468279E-10
|
|
2.94930323403E-10 3.02396519542E-10 3.10051723307E-10 3.17900719449E-10
|
|
3.25948413844E-10 3.34199836559E-10 3.42660145001E-10 3.51334627135E-10
|
|
3.60228704793E-10 3.69347937058E-10 3.78698023745E-10 3.88284808960E-10
|
|
3.98114284752E-10 4.08192594860E-10 4.18526038552E-10 4.29121074564E-10
|
|
4.39984325132E-10 4.51122580139E-10 4.62542801351E-10 4.74252126775E-10
|
|
4.86257875114E-10 4.98567550347E-10 5.11188846417E-10 5.24129652037E-10
|
|
5.37398055628E-10 5.51002350367E-10 5.64951039373E-10 5.79252841026E-10
|
|
5.93916694409E-10 6.08951764899E-10 6.24367449898E-10 6.40173384701E-10
|
|
6.56379448524E-10 6.72995770674E-10 6.90032736884E-10 7.07500995801E-10
|
|
7.25411465644E-10 7.43775341030E-10 7.62604099966E-10 7.81909511025E-10
|
|
8.01703640706E-10 8.21998860969E-10 8.42807856972E-10 8.64143635000E-10
|
|
8.86019530592E-10 9.08449216878E-10 9.31446713123E-10 9.55026393493E-10
|
|
9.79202996034E-10 1.00399163189E-09 1.02940779474E-09 1.05546737049E-09
|
|
1.08218664721E-09 1.10958232528E-09 1.13767152786E-09 1.16647181160E-09
|
|
1.19600117757E-09 1.22627808257E-09 1.25732145060E-09 1.28915068476E-09
|
|
1.32178567930E-09 1.35524683214E-09 1.38955505753E-09 1.42473179919E-09
|
|
1.46079904368E-09 1.49777933417E-09 1.53569578447E-09 1.57457209357E-09
|
|
1.61443256036E-09 1.65530209888E-09 1.69720625385E-09 1.74017121668E-09
|
|
1.78422384179E-09 1.82939166344E-09 1.87570291292E-09 1.92318653619E-09
|
|
1.97187221197E-09 2.02179037031E-09 2.07297221161E-09 2.12544972606E-09
|
|
2.17925571375E-09 2.23442380504E-09 2.29098848169E-09 2.34898509834E-09
|
|
2.40844990465E-09 2.46942006792E-09 2.53193369636E-09 2.59602986288E-09
|
|
2.66174862952E-09 2.72913107250E-09 2.79821930786E-09 2.86905651784E-09
|
|
2.94168697781E-09 3.01615608399E-09 3.09251038178E-09 3.17079759490E-09
|
|
3.25106665519E-09 3.33336773318E-09 3.41775226949E-09 3.50427300693E-09
|
|
3.59298402352E-09 3.68394076624E-09 3.77720008572E-09 3.87282027175E-09
|
|
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1 3 1 i j (l(j))
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0.00000000000E+00 Q_int
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1 4 1 i j (l(j))
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0.00000000000E+00 Q_int
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1.56958684228E-12 1.62956388925E-12 1.69183277891E-12 1.75648108713E-12
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1 5 1 i j (l(j))
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|
0.00000000000E+00 Q_int
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1 6 1 i j (l(j))
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0.00000000000E+00 Q_int
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2 2 0 i j (l(j))
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-1.08577119111E-01 Q_int
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2 4 1 i j (l(j))
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0.00000000000E+00 Q_int
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2 8 2 i j (l(j))
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0.00000000000E+00 Q_int
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2 9 2 i j (l(j))
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0.00000000000E+00 Q_int
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4.47739961243E-18 4.70696079889E-18 4.94829183901E-18 5.20199618611E-18
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-1.20454377485E-02 Q_int
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3 6 1 i j (l(j))
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3 7 2 i j (l(j))
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0.00000000000E+00 Q_int
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8.73096388978E-17 9.29406265993E-17 9.89347817859E-17 1.05315526746E-16
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3 8 2 i j (l(j))
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|
0.00000000000E+00 Q_int
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3 9 2 i j (l(j))
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0.00000000000E+00 Q_int
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1.06678399171E-20 1.13558564797E-20 1.20882462981E-20 1.28678712015E-20
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5.66468328885E-03 4.82756701102E-03 4.05141083569E-03 3.33875297280E-03
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7.69101393106E-04 4.51475407423E-04 1.94687202279E-04 -4.88200867829E-06
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-1.51639345771E-04 -2.50727855122E-04 -3.07951380185E-04 -3.29674785738E-04
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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3 10 2 i j (l(j))
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|
0.00000000000E+00 Q_int
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1.04899491579E-23 1.11664927529E-23 1.18866696610E-23 1.26532939890E-23
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6.97730190075E-21 7.42729921118E-21 7.90631885462E-21 8.41623261074E-21
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8.95903297861E-21 9.53684096247E-21 1.01519143596E-20 1.08066565825E-20
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1.15036260509E-20 1.22455461879E-20 1.30353160626E-20 1.38760217180E-20
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7.65154038828E-18 8.14502233884E-18 8.67033114018E-18 9.22951944776E-18
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9.82477230194E-18 1.04584156661E-17 1.11329255153E-17 1.18509375113E-17
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3.42918240175E-17 3.65034565983E-17 3.88577272208E-17 4.13638352478E-17
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5.65376589310E-17 6.01840245425E-17 6.40655605212E-17 6.81974340516E-17
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7.25957905178E-17 7.72778165913E-17 8.22618073888E-17 8.75672379605E-17
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9.32148393894E-17 9.92266797980E-17 1.05626250581E-16 1.12438558196E-16
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1.19690221882E-16 1.27409577666E-16 1.35626789097E-16 1.44373965101E-16
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2.92872088227E-14 3.11760708166E-14 3.31867538794E-14 3.53271147893E-14
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3.76055170425E-14 4.00308635340E-14 4.26126313452E-14 4.53609087764E-14
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4.82864347665E-14 5.14006408554E-14 5.47156958536E-14 5.82445533909E-14
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6.20010025338E-14 6.59997216658E-14 7.02563358437E-14 7.47874778522E-14
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7.96108531973E-14 8.47453092901E-14 9.02109090937E-14 9.60290095189E-14
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1.02222344877E-13 1.08815115714E-13 1.15833083375E-13 1.23303670664E-13
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1.31256069005E-13 1.39721352499E-13 1.48732599355E-13 1.58325021137E-13
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4 5 1 i j (l(j))
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0.00000000000E+00 Q_int
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4 6 1 i j (l(j))
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0.00000000000E+00 Q_int
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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4 7 2 i j (l(j))
|
|
0.00000000000E+00 Q_int
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|
1.51041167632E-23 1.60782486013E-23 1.71152065452E-23 1.82190425306E-23
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5.48513593516E-19 5.83889680961E-19 6.21547330027E-19 6.61633688795E-19
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9.04346029198E-19 9.62671337070E-19 1.02475830412E-18 1.09084953652E-18
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1.16120328719E-18 1.23609446496E-18 1.31581570872E-18 1.40067853096E-18
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1.49101453502E-18 1.58717671078E-18 1.68954081405E-18 1.79850683477E-18
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6.68226355756E-18 7.11323253078E-18 7.57199661481E-18 8.06034844029E-18
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8.58019625258E-18 9.13357136834E-18 9.72263611287E-18 1.03496922695E-17
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1.10171900737E-17 1.17277377878E-17 1.24841118923E-17 1.32892679357E-17
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1.41463520825E-17 1.50587134078E-17 1.60299169833E-17 1.70637578082E-17
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3.84537719087E-17 4.09338271298E-17 4.35738321712E-17 4.63841029102E-17
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4.93756205408E-17 5.25600744833E-17 5.59499080610E-17 5.95583671222E-17
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6.33995517995E-17 6.74884716055E-17 7.18411040835E-17 7.64744572398E-17
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8.14066360028E-17 8.66569129683E-17 9.22458037082E-17 9.81951469347E-17
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1.04528189836E-16 1.11269678916E-16 1.18445956689E-16 1.26085064618E-16
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1.34216852682E-16 1.42873096023E-16 1.52087619098E-16 1.61896427858E-16
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1.72337850437E-16 1.83452686921E-16 1.95284368777E-16 2.07879128559E-16
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5.70704606690E-15 6.07511892431E-15 6.46693044234E-15 6.88401163316E-15
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9.40932836932E-15 1.00161779300E-14 1.06621659265E-14 1.13498165711E-14
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8.92732315781E-14 9.50308607807E-14 1.01159825203E-13 1.07684073913E-13
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1.14629100561E-13 1.22022042997E-13 1.29891789311E-13 1.38269090717E-13
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1.47186681712E-13 1.56679407987E-13 1.66784362586E-13 1.77541030852E-13
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1.88991444713E-13 2.01180346925E-13 2.14155365903E-13 2.27967201834E-13
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2.66120845539E-10 2.83284195013E-10 3.01554487938E-10 3.21003116443E-10
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4 8 2 i j (l(j))
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0.00000000000E+00 Q_int
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1.65683755344E-23 1.76369439497E-23 1.87744291067E-23 1.99852757535E-23
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2.59172999427E-22 2.75888221792E-22 2.93681483379E-22 3.12622311745E-22
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3.32784718588E-22 3.54247488950E-22 3.77094489075E-22 4.01414994110E-22
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4.27304036958E-22 4.54862779617E-22 4.84198908473E-22 5.15427055085E-22
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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4 9 2 i j (l(j))
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|
0.00000000000E+00 Q_int
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1.49518819009E-23 1.59161954340E-23 1.69427018465E-23 1.80354122347E-23
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1.09061474846E-17 1.16095335673E-17 1.23582841550E-17 1.31553250068E-17
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3.80661952162E-17 4.05212538900E-17 4.31346502455E-17 4.59165961860E-17
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8.05861361877E-17 8.57834954668E-17 9.13160556231E-17 9.72054352560E-17
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1.03474647245E-16 1.10148188672E-16 1.17252136547E-16 1.24814249700E-16
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1.32864077254E-16 1.41433074086E-16 1.50554723737E-16 1.60264669252E-16
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2.66864643179E-15 2.84075934340E-15 3.02397258447E-15 3.21900206479E-15
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3.42660986634E-15 3.64760722119E-15 3.88285768138E-15 4.13328049326E-15
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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4 10 2 i j (l(j))
|
|
0.00000000000E+00 Q_int
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|
1.61089825246E-23 1.71479226362E-23 1.82538686282E-23 1.94311420086E-23
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9.15103041072E-18 9.74122116732E-18 1.03694759576E-17 1.10382497008E-17
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1.43146202069E-16 1.52378338998E-16 1.62205897610E-16 1.72667279306E-16
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5 7 2 i j (l(j))
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0.00000000000E+00 Q_int
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5 8 2 i j (l(j))
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0.00000000000E+00 Q_int
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5 9 2 i j (l(j))
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0.00000000000E+00 Q_int
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5 10 2 i j (l(j))
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0.00000000000E+00 Q_int
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6 7 2 i j (l(j))
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0.00000000000E+00 Q_int
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6 8 2 i j (l(j))
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0.00000000000E+00 Q_int
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6 9 2 i j (l(j))
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0.00000000000E+00 Q_int
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6 10 2 i j (l(j))
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0.00000000000E+00 Q_int
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7 8 2 i j (l(j))
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8.32146576965E-01 Q_int
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1.49865755420E-17 1.61537912545E-17 1.74119144667E-17 1.87680254210E-17
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
|
|
7 9 2 i j (l(j))
|
|
0.00000000000E+00 Q_int
|
|
8.15817785442E-26 8.79357060839E-26 9.47845038737E-26 1.02166714463E-25
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3.62799589590E-22 3.91055926841E-22 4.21512984848E-22 4.54342164873E-22
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6.61063942231E-22 7.12550344436E-22 7.68046721189E-22 8.27865385935E-22
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8.92342976384E-22 9.61842348987E-22 1.03675462096E-21 1.11750137134E-21
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9.83645282717E-21 1.06025565442E-20 1.14283275925E-20 1.23184131108E-20
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1.32778221764E-20 1.43119539939E-20 1.54266282807E-20 1.66281180176E-20
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1.79231847512E-20 1.93191166450E-20 2.08237694953E-20 2.24456109399E-20
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2.41937681114E-20 2.60780790011E-20 2.81091478237E-20 3.02984046943E-20
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3.26581699520E-20 3.52017234952E-20 3.79433795156E-20 4.08985670530E-20
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4.40839168249E-20 4.75173548175E-20 5.12182031668E-20 5.52072888965E-20
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5.95070611250E-20 6.41417174004E-20 6.91373398759E-20 7.45220420903E-20
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8.03261271807E-20 8.65822584174E-20 9.33256430211E-20 1.00594230296E-19
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1.08428925193E-19 1.16873818512E-19 1.25976435024E-19 1.35788000926E-19
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1.46363732120E-19 1.57763144951E-19 1.70050391145E-19 1.83294618823E-19
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1.97570361650E-19 2.12957958278E-19 2.29544004464E-19 2.47421840398E-19
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2.66692075989E-19 2.87463157058E-19 3.09851975633E-19 3.33984527771E-19
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3.59996622623E-19 3.88034646711E-19 4.18256387741E-19 4.50831922575E-19
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4.85944574356E-19 5.23791944186E-19 5.64587023151E-19 6.08559390955E-19
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6.55956507911E-19 7.07045107553E-19 7.62112697716E-19 8.21469178522E-19
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8.85448586380E-19 9.54410973823E-19 1.02874443574E-18 1.10886729346E-18
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1.19523044885E-18 1.28831992187E-18 1.38865958572E-18 1.49681411494E-18
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1.61339216327E-18 1.73904978885E-18 1.87449414632E-18 2.02048746638E-18
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2.17785134540E-18 2.34747136897E-18 2.53030209572E-18 2.72737242917E-18
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2.93979140803E-18 3.16875444745E-18 3.41555006634E-18 3.68156713872E-18
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3.96830270973E-18 4.27737042043E-18 4.61050958880E-18 4.96959499794E-18
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5.35664744661E-18 5.77384512157E-18 6.22353585554E-18 6.70825033991E-18
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7.23071636653E-18 7.79387417866E-18 8.40089301754E-18 9.05518895766E-18
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9.76044413109E-18 1.05206274492E-17 1.13400169379E-17 1.22232238132E-17
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1.31752184309E-17 1.42013582579E-17 1.53074180221E-17 1.64996222105E-17
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1.77846800975E-17 1.91698235030E-17 2.06628474895E-17 2.22721542299E-17
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2.40068002921E-17 2.58765476049E-17 2.78919183951E-17 3.00642544023E-17
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3.24057807051E-17 3.49296745199E-17 3.76501393564E-17 4.05824849498E-17
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4.37432134175E-17 4.71501121264E-17 5.08223537935E-17 5.47806043821E-17
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5.90471394011E-17 6.36459692633E-17 6.86029744058E-17 7.39460509348E-17
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7.97052676135E-17 8.59130350770E-17 9.26042882260E-17 9.98166828260E-17
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1.07590807419E-16 1.15970411738E-16 1.25002652914E-16 1.34738360856E-16
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1.45232324299E-16 1.56543599136E-16 1.68735840756E-16 1.81877662272E-16
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4.82187015675E-16 5.19741635855E-16 5.60221154579E-16 6.03853373916E-16
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6.50883837976E-16 7.01577214733E-16 7.56218785446E-16 8.15116050099E-16
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8.78600457867E-16 9.47029272355E-16 1.02078758212E-15 1.10029046777E-15
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1.18598533782E-15 1.27835444654E-15 1.37791760782E-15 1.48523512042E-15
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1.60091092111E-15 1.72559598331E-15 1.85999198043E-15 2.00485523459E-15
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2.16100097278E-15 2.32930791460E-15 2.51072321722E-15 2.70626780552E-15
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2.91704211732E-15 3.14423229612E-15 3.38911686609E-15 3.65307392690E-15
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3.93758890903E-15 4.24426293291E-15 4.57482181923E-15 4.93112580093E-15
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5.31517999156E-15 5.72914566903E-15 6.17535243802E-15 6.65631133978E-15
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7.17472898286E-15 7.73352277433E-15 8.33583733738E-15 8.98506220739E-15
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9.68485090632E-15 1.04391415026E-14 1.12521787722E-14 1.21285380859E-14
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1.30731511565E-14 1.40913337915E-14 1.51888158077E-14 1.63717732743E-14
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1.76468632686E-14 1.90212613375E-14 2.05027018771E-14 2.20995216566E-14
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2.38207067328E-14 2.56759430168E-14 2.76756707807E-14 2.98311434080E-14
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3.21544907200E-14 3.46587872342E-14 3.73581257383E-14 4.02676965948E-14
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4.34038732212E-14 4.67843042279E-14 5.04280127314E-14 5.43555034025E-14
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5.85888778514E-14 6.31519589978E-14 6.80704251290E-14 7.33719543965E-14
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7.90863805667E-14 8.52458609017E-14 9.18850571138E-14 9.90413304131E-14
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1.06754951745E-13 1.15069328401E-13 1.24031248277E-13 1.33691143154E-13
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1.44103372487E-13 1.55326529286E-13 1.67423769825E-13 1.80463169030E-13
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1.94518103537E-13 2.09667664587E-13 2.25997103072E-13 2.43598309248E-13
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7.84443336700E-11 8.45529615338E-11 9.11372555666E-11 9.82342522361E-11
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1.05883871337E-10 1.14129140913E-10 1.23016438376E-10 1.32595752146E-10
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1.42920962135E-10 1.54050142538E-10 1.66045889253E-10 1.78975670897E-10
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8.64239249688E-10 9.31526681208E-10 1.00405230792E-09 1.08222384615E-09
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1.16648074051E-09 1.25729663233E-09 1.35518201857E-09 1.46068711972E-09
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1.57440496997E-09 1.69697474659E-09 1.82908535997E-09 1.97147932217E-09
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2.12495691494E-09 2.29038068368E-09 2.46868027825E-09 2.66085767412E-09
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2.86799279553E-09 3.09124957715E-09 3.33188249550E-09 3.59124361486E-09
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3.87079016474E-09 4.17209272676E-09 4.49684404544E-09 4.84686852006E-09
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5.22413244504E-09 5.63075503978E-09 6.06902033308E-09 6.54138997835E-09
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7 10 2 i j (l(j))
|
|
0.00000000000E+00 Q_int
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|
8.92156036204E-26 9.61640851431E-26 1.03653743248E-25 1.11726727014E-25
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1.20428468263E-25 1.29807937240E-25 1.39917918192E-25 1.50815306424E-25
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2.96206234700E-25 3.19276005722E-25 3.44142546266E-25 3.70945796200E-25
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5.39722948242E-25 5.81758811659E-25 6.27068602591E-25 6.75907308104E-25
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|
1.32750423887E-24 1.43089577891E-24 1.54233988122E-24 1.66246371275E-24
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1.79194328686E-24 1.93150726759E-24 2.08194107040E-24 2.24409128213E-24
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2.41887042535E-24 2.60726209364E-24 2.81032648695E-24 3.02920637802E-24
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3.26513354342E-24 3.51943569565E-24 3.79354395494E-24 4.08900090310E-24
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4.40746926461E-24 4.75074126386E-24 5.12074871109E-24 5.51957387393E-24
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5.94946119568E-24 6.41282992618E-24 6.91228773649E-24 7.45064539392E-24
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1.46333131737E-23 1.57730163351E-23 1.70014843084E-23 1.83256304656E-23
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1.97529066206E-23 2.12913449657E-23 2.29496032734E-23 2.47370136196E-23
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2.66636349011E-23 2.87403094431E-23 3.09787240162E-23 3.33914756051E-23
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3.59921423000E-23 3.87953597090E-23 4.18169033223E-23 4.50737772905E-23
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4.85843101181E-23 5.23682578095E-23 5.64469150488E-23 6.08432350382E-23
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8 8 2 i j (l(j))
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9.07271437760E-01 Q_int
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8 9 2 i j (l(j))
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0.00000000000E+00 Q_int
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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8 10 2 i j (l(j))
|
|
0.00000000000E+00 Q_int
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|
1.00707128307E-25 1.08550617470E-25 1.17004990126E-25 1.26117824417E-25
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1.35940404066E-25 1.46528006989E-25 1.57940216374E-25 1.70241255994E-25
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2.47699565709E-25 2.66991436018E-25 2.87785837260E-25 3.10199792781E-25
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3.34359440191E-25 3.60400741220E-25 3.88470246860E-25 4.18725922106E-25
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4.51338034920E-25 4.86490114441E-25 5.24379983817E-25 5.65220873486E-25
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6.09242621156E-25 6.56692965251E-25 7.07838939091E-25 7.62968373659E-25
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8.22391517410E-25 8.86442782235E-25 9.55482625412E-25 1.02989957813E-24
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1.11011243199E-24 1.19657259584E-24 1.28976663611E-24 1.39021901503E-24
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|
1.49849504215E-24 1.61520405566E-24 1.74100285154E-24 1.87659937977E-24
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2.02275672840E-24 2.18029741797E-24 2.35010803029E-24 2.53314419790E-24
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2.73043598191E-24 2.94309366890E-24 3.17231401916E-24 3.41938700165E-24
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3.68570305347E-24 3.97276090470E-24 4.28217601277E-24 4.61568965363E-24
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4.97517872102E-24 5.36266628897E-24 5.78033299689E-24 6.23052932144E-24
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6.71578880418E-24 7.23884230938E-24 7.80263339234E-24 8.41033486468E-24
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9.06536664976E-24 9.77141502875E-24 1.05324533857E-23 1.13527645683E-23
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1.22369649902E-23 1.31900306104E-23 1.42173249364E-23 1.53246292078E-23
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1.65181749313E-23 1.78046789489E-23 1.91913812383E-23 2.06860856568E-23
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2.22972038584E-23 2.40338026314E-23 2.59056549236E-23 2.79232948402E-23
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3.00980769264E-23 3.24422400664E-23 3.49689763595E-23 3.76925053604E-23
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4.06281541018E-23 4.37924433492E-23 4.72031805739E-23 5.08795601670E-23
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5.48422714582E-23 5.91136151484E-23 6.37176288092E-23 6.86802221583E-23
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7.40293228695E-23 7.97950337398E-23 8.60098020969E-23 9.27086024008E-23
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9.99291330679E-23 1.07712028623E-22 1.16101088377E-22 1.25143522913E-22
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1.34890219769E-22 1.45396029816E-22 1.56720075939E-22 1.68926085757E-22
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1.82082750262E-22 1.96264110385E-22 2.11549973670E-22 2.28026363407E-22
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2.45786002733E-22 2.64928836449E-22 2.85562593472E-22 3.07803393093E-22
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|
3.31776398456E-22 3.57616520927E-22 3.85469179333E-22 4.15491118318E-22
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|
4.47851290450E-22 4.82731807026E-22 5.20328962923E-22 5.60854341277E-22
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6.04536004198E-22 6.51619776216E-22 7.02370627697E-22 7.57074165995E-22
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|
8.16038242751E-22 8.79594686366E-22 9.48101169414E-22 1.02194322149E-21
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1.10153639883E-21 1.18732862293E-21 1.27980270123E-21 1.37947904425E-21
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|
1.48691859423E-21 1.60272598190E-21 1.72755292915E-21 1.86210191668E-21
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2.00713013728E-21 2.16345375706E-21 2.33195250853E-21 2.51357464141E-21
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2.70934225903E-21 2.92035707037E-21 3.14780659007E-21 3.39297082132E-21
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3.65722945927E-21 3.94206965544E-21 4.24909438686E-21 4.58003147706E-21
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4.93674331962E-21 5.32123735904E-21 5.73567738790E-21 6.18239572394E-21
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6.66390633541E-21 7.18291898885E-21 7.74235449863E-21 8.34536116421E-21
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8.99533248768E-21 9.69592627107E-21 1.04510852012E-20 1.12650590377E-20
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1.21424285289E-20 1.30881311910E-20 1.41074890941E-20 1.52062388134E-20
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1.63905637122E-20 1.76671287397E-20 1.90431179388E-20 2.05262748756E-20
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2.21249462169E-20 2.38481287026E-20 2.57055197758E-20 2.77075721565E-20
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2.98655526660E-20 3.21916056317E-20 3.46988212319E-20 3.74013091618E-20
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4.03142780381E-20 4.34541209871E-20 4.68385078998E-20 5.04864848710E-20
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3.94294152034E-02 3.41429424891E-02 2.93493785757E-02 2.50308900137E-02
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2.11673981713E-02 1.77367666538E-02 1.47150241821E-02 1.20766208537E-02
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9.79471474628E-03 7.84148485353E-03 6.18846538812E-03 4.80689558170E-03
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3.66807829366E-03 2.74374003992E-03 2.00638450830E-03 1.42963126716E-03
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9.88531228466E-04 6.59850515772E-04 4.22314727154E-04 2.56806177427E-04
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1.46507550966E-04 7.69864828235E-05 3.62168917228E-05 1.45343880181E-05
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4.52474417588E-06 8.46218416284E-07 -1.15556807768E-08 -2.73661730950E-08
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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9 9 2 i j (l(j))
|
|
7.58445792022E-01 Q_int
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8.09612550265E-26 8.72668536190E-26 9.40635584026E-26 1.01389618766E-25
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1.09286263119E-25 1.17797930910E-25 1.26972522719E-25 1.36861669819E-25
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9.68620470896E-18 1.04406059575E-17 1.12537630456E-17 1.21302521156E-17
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9 10 2 i j (l(j))
|
|
8.06622422380E-01 Q_int
|
|
8.85368717696E-26 9.54324908386E-26 1.02865169342E-25 1.10876735699E-25
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6.19657169325E-03 6.64581332487E-03 7.12671604419E-03 7.64141902479E-03
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8.19219662635E-03 8.78146598611E-03 9.41179493775E-03 1.00859102610E-02
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1.08067062636E-02 1.15772536960E-02 1.24008089961E-02 1.32808238616E-02
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1.42209551415E-02 1.52250750388E-02 1.62972816119E-02 1.74419095583E-02
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1.86635412609E-02 1.99670180736E-02 2.13574518165E-02 2.28402364470E-02
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2.44210598681E-02 2.61059158258E-02 2.79011158451E-02 2.98133011429E-02
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8.84710812637E-02 9.40618484419E-02 9.99707628104E-02 1.06212560389E-01
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1.12802331090E-01 1.19755491572E-01 1.27087753192E-01 1.34815084663E-01
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1.42953669013E-01 1.51519854424E-01 1.60530098545E-01 1.70000905840E-01
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|
1.79948757577E-01 1.90390034028E-01 2.01340928495E-01 2.12817352784E-01
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2.24834833765E-01 2.37408400713E-01 2.50552463147E-01 2.64280678944E-01
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2.78605812560E-01 2.93539583276E-01 3.09092503461E-01 3.25273706932E-01
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3.42090767632E-01 3.59549508935E-01 3.77653804048E-01 3.96405368142E-01
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4.15803542976E-01 4.35845075016E-01 4.56523888196E-01 4.77830852733E-01
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4.99753551592E-01 5.22276046479E-01 5.45378645448E-01 5.69037674512E-01
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5.93225255892E-01 6.17909095795E-01 6.43052284921E-01 6.68613115123E-01
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6.94544915916E-01 7.20795914770E-01 7.47309125327E-01 7.74022267875E-01
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8.00867726536E-01 8.27772547769E-01 8.54658484765E-01 8.81442092358E-01
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9.08034876921E-01 9.34343505573E-01 9.60270078707E-01 9.85712469513E-01
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1.01056473362E+00 1.03471759140E+00 1.05805898475E+00 1.08047470920E+00
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1.10184912131E+00 1.12206592011E+00 1.14100900003E+00 1.15856337148E+00
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1.17461614361E+00 1.18905756227E+00 1.20178209459E+00 1.21268954970E+00
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1.22168622353E+00 1.22868605405E+00 1.23361177134E+00 1.23639602588E+00
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1.23698247670E+00 1.23532682013E+00 1.23139773924E+00 1.22517775327E+00
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1.21666394665E+00 1.20586855749E+00 1.19281940622E+00 1.17756014696E+00
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1.16015032564E+00 1.14066523223E+00 1.11919553697E+00 1.09584670490E+00
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1.07073818668E+00 1.04400238893E+00 1.01578343183E+00 9.86235707427E-01
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9.55522256910E-01 9.23812990651E-01 8.91282779381E-01 8.58109449329E-01
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8.24471717753E-01 7.90547107999E-01 7.56509884948E-01 7.22529052105E-01
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6.88766450786E-01 6.55374999664E-01 6.22497109380E-01 5.90263302222E-01
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5.58791061000E-01 5.28183924664E-01 4.98530841003E-01 4.69905779523E-01
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4.42367600552E-01 4.15960170286E-01 3.90712706238E-01 3.66640333658E-01
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3.43744831291E-01 3.22015544351E-01 3.01430443735E-01 2.81957313146E-01
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2.63555049277E-01 2.46175064156E-01 2.29762782158E-01 2.14259226358E-01
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1.99602688988E-01 1.85730477917E-01 1.72580725022E-01 1.60094232780E-01
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1.48216322807E-01 1.36898635272E-01 1.26100812534E-01 1.15791985885E-01
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1.05951973118E-01 9.65736421423E-02 8.76633578631E-02 7.92283060692E-02
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7.12736727279E-02 6.38025249583E-02 5.68157081614E-02 5.03117624816E-02
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4.42868617139E-02 3.87347776309E-02 3.36468724673E-02 2.90121219752E-02
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2.48171710376E-02 2.10464232999E-02 1.76821656659E-02 1.47047277911E-02
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1.20926759247E-02 9.82303960382E-03 7.87156881214E-03 6.21301830942E-03
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4.82145493508E-03 3.67058282956E-03 2.73408072358E-03 1.98594475534E-03
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1.40082971653E-03 9.54381226260E-04 6.23551108484E-04 3.86888214588E-04
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|
2.24797090010E-04 1.19757221596E-04 5.64960963126E-05 2.21099144416E-05
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|
6.12648091666E-06 5.05487160005E-07 -4.27972886824E-07 -1.20298548567E-07
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|
6.93889390391E-18 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
|
|
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
|
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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|
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
|
|
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
|
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
|
|
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
|
|
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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|
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
|
|
0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
|
|
10 10 2 i j (l(j))
|
|
8.58613719791E-01 Q_int
|
|
9.68204110041E-26 1.04361186492E-25 1.12489268874E-25 1.21250400049E-25
|
|
1.30693884485E-25 1.40872866687E-25 1.51844630272E-25 1.63670920345E-25
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|
1.76418290977E-25 1.90158479744E-25 2.04968811443E-25 2.20932633248E-25
|
|
2.38139783755E-25 2.56687098565E-25 2.76678955237E-25 2.98227860685E-25
|
|
3.21455084331E-25 3.46491340563E-25 3.73477524347E-25 4.02565504133E-25
|
|
4.33918976519E-25 4.67714387470E-25 5.04141925298E-25 5.43406590968E-25
|
|
5.85729351772E-25 6.31348384853E-25 6.80520417575E-25 7.33522172298E-25
|
|
7.90651923666E-25 8.52231177190E-25 9.18606478568E-25 9.90151363910E-25
|
|
1.06726846187E-24 1.15039175950E-24 1.23998904455E-24 1.33656453804E-24
|
|
1.44066173179E-24 1.55286644705E-24 1.67381013124E-24 1.80417341152E-24
|
|
1.94468992514E-24 2.09615044804E-24 2.25940734510E-24 2.43537936689E-24
|
|
2.62505682008E-24 2.82950714057E-24 3.04988090057E-24 3.28741828363E-24
|
|
3.54345606395E-24 3.81943512925E-24 4.11690858956E-24 4.43755051756E-24
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|
4.78316536968E-24 5.15569814089E-24 5.55724531044E-24 5.99006664007E-24
|
|
6.45659789118E-24 6.95946453233E-24 7.50149651449E-24 8.08574419697E-24
|
|
8.71549551369E-24 9.39429447653E-24 1.01259611197E-23 1.09146129976E-23
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|
1.17646883566E-23 1.26809711126E-23 1.36686177722E-23 1.47331864524E-23
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|
1.58806681595E-23 1.71175205039E-23 1.84507040418E-23 1.98877214463E-23
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|
2.14366597298E-23 2.31062357548E-23 2.49058452892E-23 2.68456158822E-23
|
|
2.89364638587E-23 3.11901557522E-23 3.36193745228E-23 3.62377909318E-23
|
|
3.90601404764E-23 4.21023063155E-23 4.53814086541E-23 4.89159010899E-23
|
|
5.27256744633E-23 5.68321687960E-23 6.12584939473E-23 6.60295596684E-23
|
|
7.11722157853E-23 7.67154032996E-23 8.26903172584E-23 8.91305823083E-23
|
|
9.60724419231E-23 1.03554962368E-22 1.11620252552E-22 1.20313701001E-22
|
|
1.29684231284E-22 1.39784577346E-22 1.50671580266E-22 1.62406508143E-22
|
|
1.75055400892E-22 1.88689441887E-22 2.03385358560E-22 2.19225854195E-22
|
|
2.36300073348E-22 2.54704103525E-22 2.74541515925E-22 2.95923948299E-22
|
|
3.18971733212E-22 3.43814575228E-22 3.70592280839E-22 3.99455545247E-22
|
|
4.30566800419E-22 4.64101129202E-22 5.00247250616E-22 5.39208581903E-22
|
|
5.81204383283E-22 6.26470991872E-22 6.75263151697E-22 7.27855447310E-22
|
|
7.84543849044E-22 8.45647378628E-22 9.11509904527E-22 9.82502077106E-22
|
|
1.05902341452E-21 1.14150455105E-21 1.23040966055E-21 1.32623906869E-21
|
|
1.42953206853E-21 1.54086995556E-21 1.66087929892E-21 1.79023546759E-21
|
|
1.92966643107E-21 2.07995685613E-21 2.24195252267E-21 2.41656508339E-21
|
|
2.60477719432E-21 2.80764804478E-21 3.02631931816E-21 3.26202161688E-21
|
|
3.51608138778E-21 3.78992838684E-21 4.08510372540E-21 4.40326854290E-21
|
|
4.74621335523E-21 5.11586813104E-21 5.51431315295E-21 5.94379072458E-21
|
|
6.40671778948E-21 6.90569953273E-21 7.44354404201E-21 8.02327811052E-21
|
|
8.64816427062E-21 9.32171915419E-21 1.00477332830E-20 1.08302924002E-20
|
|
1.16738004637E-20 1.25830044297E-20 1.35630209672E-20 1.46193652524E-20
|
|
1.57579820062E-20 1.69852789490E-20 1.83081628610E-20 1.97340784509E-20
|
|
2.12710502523E-20 2.29277277824E-20 2.47134342187E-20 2.66382188662E-20
|
|
2.87129137114E-20 3.09491943807E-20 3.33596458463E-20 3.59578332504E-20
|
|
3.87583782441E-20 4.17770412734E-20 4.50308102727E-20 4.85379962670E-20
|
|
5.23183364196E-20 5.63931051053E-20 6.07852336352E-20 6.55194393055E-20
|
|
7.06223644976E-20 7.61227266112E-20 8.20514796756E-20 8.84419885477E-20
|
|
9.53302166771E-20 1.02754928495E-19 1.10757907566E-19 1.19384191731E-19
|
|
1.28682326565E-19 1.38704638570E-19 1.49507529653E-19 1.61151794534E-19
|
|
1.73702962875E-19 1.87231668059E-19 2.01814044687E-19 2.17532157036E-19
|
|
2.34474460887E-19 2.52736301320E-19 2.72420449283E-19 2.93637679947E-19
|
|
3.16507396111E-19 3.41158300151E-19 3.67729118316E-19 3.96369381422E-19
|
|
4.27240266363E-19 4.60515503148E-19 4.96382352592E-19 5.35042660152E-19
|
|
5.76713991837E-19 6.21630858588E-19 6.70046036018E-19 7.22231986945E-19
|
|
7.78482394702E-19 8.39113815886E-19 9.04467461817E-19 9.74911118747E-19
|
|
1.05084121763E-18 1.13268506508E-18 1.22090324809E-18 1.31599222606E-18
|
|
1.41848712469E-18 1.52896474741E-18 1.64804682151E-18 1.77640349688E-18
|
|
1.91475711747E-18 2.06388628628E-18 2.22463024710E-18 2.39789360745E-18
|
|
2.58465142936E-18 2.78595471663E-18 3.00293632955E-18 3.23681736016E-18
|
|
3.48891400408E-18 3.76064496763E-18 4.05353945169E-18 4.36924575753E-18
|
|
4.70954056280E-18 5.07633891998E-18 5.47170503361E-18 5.89786387680E-18
|
|
6.35721371259E-18 6.85233959040E-18 7.38602789374E-18 7.96128202090E-18
|
|
8.58133928694E-18 9.24968914205E-18 9.97009280881E-18 1.07466044490E-17
|
|
1.15835939787E-17 1.24857716607E-17 1.34582146118E-17 1.45063953752E-17
|
|
1.56362127175E-17 1.68540248250E-17 1.81666850846E-17 1.95815806527E-17
|
|
2.11066740267E-17 2.27505478551E-17 2.45224532371E-17 2.64323617843E-17
|
|
2.84910217372E-17 3.07100184514E-17 3.31018395965E-17 3.56799454306E-17
|
|
3.84588445503E-17 4.14541755388E-17 4.46827949736E-17 4.81628722891E-17
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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0.00000000000E+00 0.00000000000E+00 0.00000000000E+00
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|
</PP_QIJ>
|
|
</PP_NONLOCAL>
|
|
|
|
|
|
<PP_PSWFC>
|
|
3D 2 4.00 Wavefunction
|
|
1.25174178928E-14 1.29957334286E-14 1.34923263563E-14 1.40078950915E-14
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|
1.45431647377E-14 1.50988881062E-14 1.56758467744E-14 1.62748521856E-14
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|
1.68967467899E-14 1.75424052291E-14 1.82127355666E-14 1.89086805651E-14
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1.96312190119E-14 2.03813670958E-14 2.11601798361E-14 2.19687525666E-14
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|
2.28082224759E-14 2.36797702071E-14 2.45846215176E-14 2.55240490038E-14
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|
2.64993738904E-14 2.75119678887E-14 2.85632551260E-14 2.96547141482E-14
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|
3.07878799994E-14 3.19643463808E-14 3.31857678922E-14 3.44538623589E-14
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3.57704132476E-14 3.71372721752E-14 3.85563615121E-14 4.00296770866E-14
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|
4.15592909916E-14 4.31473544987E-14 4.47961010839E-14 4.65078495689E-14
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|
4.82850073820E-14 5.01300739442E-14 5.20456441846E-14 5.40344121895E-14
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|
5.60991749916E-14 5.82428365038E-14 6.04684116035E-14 6.27790303724E-14
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6.51779424990E-14 6.76685218488E-14 7.02542712094E-14 7.29388272170E-14
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|
7.57259654709E-14 7.86196058436E-14 8.16238179938E-14 8.47428270898E-14
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|
8.79810197523E-14 9.13429502232E-14 9.48333467715E-14 9.84571183423E-14
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|
1.02219361462E-13 1.06125367404E-13 1.10180629634E-13 1.14390851533E-13
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1.18761954418E-13 1.23300085874E-13 1.28011628395E-13 1.32903208365E-13
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1.37981705375E-13 1.43254261897E-13 1.48728293334E-13 1.54411498443E-13
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1.60311870170E-13 1.66437706883E-13 1.72797624050E-13 1.79400566353E-13
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1.86255820268E-13 1.93373027124E-13 2.00762196668E-13 2.08433721136E-13
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2.16398389874E-13 2.24667404511E-13 2.33252394709E-13 2.42165434527E-13
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2.51419059396E-13 2.61026283750E-13 2.71000619332E-13 2.81356094195E-13
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2.92107272432E-13 3.03269274659E-13 3.14857799282E-13 3.26889144571E-13
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3.39380231591E-13 3.52348627989E-13 3.65812572711E-13 3.79791001647E-13
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3.94303574266E-13 4.09370701266E-13 4.25013573276E-13 4.41254190663E-13
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4.58115394471E-13 4.75620898547E-13 4.93795322890E-13 5.12664228279E-13
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5.32254152222E-13 5.52592646277E-13 5.73708314803E-13 5.95630855189E-13
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6.18391099619E-13 6.42021058436E-13 6.66553965166E-13 6.92024323249E-13
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7.18467954574E-13 7.45922049855E-13 7.74425220936E-13 8.04017555100E-13
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8.34740671441E-13 8.66637779404E-13 8.99753739554E-13 9.34135126665E-13
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9.69830295229E-13 1.00688944746E-12 1.04536470389E-12 1.08531017669E-12
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|
1.12678204577E-12 1.16983863777E-12 1.21454050812E-12 1.26095052620E-12
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1.30913396372E-12 1.35915858660E-12 1.41109475021E-12 1.46501549831E-12
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1.52099666587E-12 1.57911698560E-12 1.63945819880E-12 1.70210517022E-12
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|
1.76714600750E-12 1.83467218503E-12 1.90477867261E-12 1.97756406906E-12
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2.05313074082E-12 2.13158496597E-12 2.21303708369E-12 2.29760164945E-12
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2.38539759608E-12 2.47654840112E-12 2.57118226038E-12 2.66943226833E-12
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|
2.77143660522E-12 2.87733873146E-12 2.98728758935E-12 3.10143781258E-12
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|
3.21994994372E-12 3.34299065996E-12 3.47073300759E-12 3.60335664531E-12
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3.74104809697E-12 3.88400101385E-12 4.03241644702E-12 4.18650313014E-12
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|
4.34647777299E-12 4.51256536626E-12 4.68499949797E-12 4.86402268202E-12
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5.04988669926E-12 5.24285295155E-12 5.44319282948E-12 5.65118809399E-12
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|
5.86713127268E-12 6.09132607119E-12 6.32408780039E-12 6.56574381977E-12
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|
6.81663399792E-12 7.07711119046E-12 7.34754173633E-12 7.62830597301E-12
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7.91979877143E-12 8.22243009135E-12 8.53662555787E-12 8.86282706011E-12
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9.20149337262E-12 9.55310080066E-12 9.91814385007E-12 1.02971359227E-11
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1.06906100386E-11 1.10991195855E-11 1.15232390971E-11 1.19635650614E-11
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1.24207167592E-11 1.28953371354E-11 1.33880937028E-11 1.38996794817E-11
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1.44308139736E-11 1.49822441738E-11 1.55547456219E-11 1.61491234921E-11
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1.67662137263E-11 1.74068842089E-11 1.80720359884E-11 1.87626045438E-11
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1.94795611008E-11 2.02239139976E-11 2.09967101027E-11 2.17990362879E-11
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2.26320209563E-11 2.34968356297E-11 2.43946965959E-11 2.53268666195E-11
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2.62946567180E-11 2.72994280053E-11 2.83425936064E-11 2.94256206442E-11
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|
3.05500323038E-11 3.17174099738E-11 3.29293954710E-11 3.41876933492E-11
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3.54940732968E-11 3.68503726252E-11 3.82584988532E-11 3.97204323899E-11
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|
4.12382293194E-11 4.28140242932E-11 4.44500335318E-11 4.61485579420E-11
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4.79119863528E-11 4.97427988752E-11 5.16435703898E-11 5.36169741690E-11
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|
5.56657856357E-11 5.77928862677E-11 6.00012676494E-11 6.22940356798E-11
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|
6.46744149402E-11 6.71457532298E-11 6.97115262738E-11 7.23753426114E-11
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7.51409486716E-11 7.80122340418E-11 8.09932369380E-11 8.40881498846E-11
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|
8.73013256106E-11 9.06372831714E-11 9.41007143043E-11 9.76964900273E-11
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|
1.01429667489E-10 1.05305497084E-10 1.09329429830E-10 1.13507125044E-10
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1.17844458294E-10 1.22347529666E-10 1.27022672341E-10 1.31876461503E-10
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1.36915723590E-10 1.42147545889E-10 1.47579286505E-10 1.53218584714E-10
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1.59073371701E-10 1.65151881719E-10 1.71462663666E-10 1.78014593112E-10
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1.84816884779E-10 1.91879105502E-10 1.99211187683E-10 2.06823443261E-10
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2.14726578214E-10 2.22931707617E-10 2.31450371272E-10 2.40294549942E-10
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2.49476682197E-10 2.59009681908E-10 2.68906956412E-10 2.79182425365E-10
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2.89850540323E-10 3.00926305059E-10 3.12425296674E-10 3.24363687499E-10
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3.36758267839E-10 3.49626469593E-10 3.62986390764E-10 3.76856820915E-10
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3.91257267595E-10 4.06207983775E-10 4.21729996329E-10 4.37845135612E-10
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4.54576066155E-10 4.71946318547E-10 4.89980322525E-10 5.08703441335E-10
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5.28142007400E-10 5.48323359355E-10 5.69275880497E-10 5.91029038705E-10
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6.13613427880E-10 6.37060810975E-10 6.61404164668E-10 6.86677725735E-10
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7.12917039208E-10 7.40159008362E-10 7.68441946614E-10 7.97805631411E-10
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8.28291360173E-10 8.59942008370E-10 8.92802089828E-10 9.26917819327E-10
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|
9.62337177604E-10 9.99109978828E-10 1.03728794066E-09 1.07692475700E-09
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|
1.11807617348E-09 1.16080006588E-09 1.20515652152E-09 1.25120792379E-09
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1.29901903983E-09 1.34865711167E-09 1.40019195080E-09 1.45369603630E-09
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1.50924461684E-09 1.56691581648E-09 1.62679074451E-09 1.68895360960E-09
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1.75349183816E-09 1.82049619733E-09 1.89006092263E-09 1.96228385049E-09
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2.03726655584E-09 2.11511449498E-09 2.19593715389E-09 2.27984820220E-09
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2.36696565305E-09 2.45741202911E-09 2.55131453481E-09 2.64880523533E-09
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|
2.75002124228E-09 2.85510490653E-09 2.96420401846E-09 3.07747201576E-09
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3.19506819925E-09 3.31715795690E-09 3.44391299647E-09 3.57551158693E-09
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3.71213880926E-09 3.85398681667E-09 4.00125510490E-09 4.15415079273E-09
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4.31288891332E-09 4.47769271662E-09 4.64879398332E-09 4.82643335085E-09
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5.01086065178E-09 5.20233526521E-09 5.40112648155E-09 5.60751388123E-09
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|
5.82178772791E-09 6.04424937668E-09 6.27521169791E-09 6.51499951724E-09
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6.76395007244E-09 7.02241348763E-09 7.29075326575E-09 7.56934679975E-09
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7.85858590335E-09 8.15887736208E-09 8.47064350536E-09 8.79432280047E-09
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|
9.13037046916E-09 9.47925912791E-09 9.84147945256E-09 1.02175408684E-08
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1.06079722666E-08 1.10133227480E-08 1.14341623954E-08 1.18710830752E-08
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1.23246992700E-08 1.27956489424E-08 1.32845944326E-08 1.37922233897E-08
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1.43192497386E-08 1.48664146846E-08 1.54344877551E-08 1.60242678821E-08
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1.66365845259E-08 1.72722988417E-08 1.79323048903E-08 1.86175308955E-08
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1.93289405498E-08 2.00675343697E-08 2.08343511022E-08 2.16304691863E-08
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2.24570082691E-08 2.33151307808E-08 2.42060435693E-08 2.51309995973E-08
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2.60912997044E-08 2.70882944367E-08 2.81233859460E-08 2.91980299615E-08
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3.03137378371E-08 3.14720786770E-08 3.26746815421E-08 3.39232377411E-08
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3.52195032088E-08 3.65653009759E-08 3.79625237320E-08 3.94131364882E-08
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4.09191793394E-08 4.24827703343E-08 4.41061084533E-08 4.57914767009E-08
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4.75412453167E-08 4.93578751081E-08 5.12439209110E-08 5.32020351829E-08
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5.52349717324E-08 5.73455895921E-08 5.95368570389E-08 6.18118557686E-08
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6.41737852289E-08 6.66259671191E-08 6.91718500606E-08 7.18150144472E-08
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7.45591774794E-08 7.74081983918E-08 8.03660838797E-08 8.34369937341E-08
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8.66252466905E-08 8.99353265020E-08 9.33718882447E-08 9.69397648634E-08
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1.00643973968E-07 1.04489724887E-07 1.08482425997E-07 1.12627692323E-07
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1.16931353439E-07 1.21399461659E-07 1.26038300553E-07 1.30854393781E-07
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1.35854514264E-07 1.41045693710E-07 1.46435232502E-07 1.52030709960E-07
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1.57839995000E-07 1.63871257199E-07 1.70132978282E-07 1.76633964047E-07
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1.83383356748E-07 1.90390647948E-07 1.97665691866E-07 2.05218719230E-07
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2.13060351665E-07 2.21201616627E-07 2.29653962903E-07 2.38429276716E-07
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2.47539898428E-07 2.56998639898E-07 2.66818802492E-07 2.77014195781E-07
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2.87599156963E-07 2.98588571015E-07 3.09997891623E-07 3.21843162906E-07
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3.34141041977E-07 3.46908822354E-07 3.60164458279E-07 3.73926589956E-07
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3.88214569757E-07 4.03048489427E-07 4.18449208331E-07 4.34438382777E-07
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4.51038496461E-07 4.68272892073E-07 4.86165804111E-07 5.04742392950E-07
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5.24028780207E-07 5.44052085465E-07 5.64840464388E-07 5.86423148306E-07
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6.08830485299E-07 6.32093982855E-07 6.56246352159E-07 6.81321554072E-07
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7.07354846862E-07 7.34382835763E-07 7.62443524425E-07 7.91576368329E-07
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8.21822330235E-07 8.53223937760E-07 8.85825343145E-07 9.19672385305E-07
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9.54812654253E-07 9.91295557976E-07 1.02917239187E-06 1.06849641085E-06
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1.10932290412E-06 1.15170927295E-06 1.19571511129E-06 1.24140228951E-06
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1.28883504135E-06 1.33808005419E-06 1.38920656269E-06 1.44228644616E-06
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1.49739432947E-06 1.55460768793E-06 1.61400695745E-06 1.67567564142E-06
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1.73970043824E-06 1.80617135749E-06 1.87518184289E-06 1.94682891213E-06
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2.02121328256E-06 2.09843951879E-06 2.17861618746E-06 2.26185599292E-06
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2.34827594697E-06 2.43799752810E-06 2.53114686040E-06 2.62785487671E-06
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2.72825751542E-06 2.83249590497E-06 2.94071656249E-06 3.05307160092E-06
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3.16971894277E-06 3.29082254434E-06 3.41655261196E-06 3.54708586154E-06
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3.68260575557E-06 3.82330276049E-06 3.96937461190E-06 4.12102660266E-06
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4.27847185809E-06 4.44193164337E-06 4.61163567367E-06 4.78782242985E-06
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|
4.97073950485E-06 5.16064393683E-06 5.35780258142E-06 5.56249247988E-06
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5.77500125191E-06 5.99562749476E-06 6.22468120725E-06 6.46248421832E-06
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6.70937064199E-06 6.96568735102E-06 7.23179445011E-06 7.50806579530E-06
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7.79488950742E-06 8.09266852477E-06 8.40182116410E-06 8.72278169460E-06
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9.05600098012E-06 9.40194707227E-06 9.76110588881E-06 1.01339818948E-05
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1.05210988021E-05 1.09230003067E-05 1.13402508403E-05 1.17734363765E-05
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1.22231652464E-05 1.26900689937E-05 1.31748032423E-05 1.36780486371E-05
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1.42005117818E-05 1.47429262344E-05 1.53060535382E-05 1.58906842687E-05
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1.64976391658E-05 1.71277702670E-05 1.77819620947E-05 1.84611329127E-05
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1.91662359920E-05 1.98982609541E-05 2.06582351468E-05 2.14472250975E-05
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2.22663379770E-05 2.31167231820E-05 2.39995738862E-05 2.49161287905E-05
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2.58676737696E-05 2.68555437150E-05 2.78811243963E-05 2.89458543843E-05
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3.00512270492E-05 3.11987926801E-05 3.23901606237E-05 3.36270015212E-05
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3.49110496690E-05 3.62441053941E-05 3.76280376241E-05 3.90647864301E-05
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4.05563657758E-05 4.21048662961E-05 4.37124582282E-05 4.53813944245E-05
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4.71140134924E-05 4.89127430432E-05 5.07801030871E-05 5.27187095219E-05
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5.47312777679E-05 5.68206265774E-05 5.89896819143E-05 6.12414810404E-05
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6.35791767223E-05 6.60060416334E-05 6.85254728730E-05 7.11409966954E-05
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7.38562733933E-05 7.66751023872E-05 7.96014274760E-05 8.26393423243E-05
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8.57930961187E-05 8.90670994531E-05 9.24659304486E-05 9.59943410655E-05
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9.96572637066E-05 1.03459818008E-04 1.07407317937E-04 1.11505279117E-04
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1.15759426468E-04 1.20175702063E-04 1.24760273384E-04 1.29519541776E-04
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1.34460151294E-04 1.39588997863E-04 1.44913238738E-04 1.50440302389E-04
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1.56177898691E-04 1.62134029529E-04 1.68316999804E-04 1.74735428800E-04
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1.81398262041E-04 1.88314783538E-04 1.95494628513E-04 2.02947796596E-04
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2.10684665494E-04 2.18716005196E-04 2.27052992674E-04 2.35707227159E-04
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2.44690745943E-04 2.54016040803E-04 2.63696075014E-04 2.73744300978E-04
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2.84174678532E-04 2.95001693907E-04 3.06240379382E-04 3.17906333681E-04
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3.30015743095E-04 3.42585403407E-04 3.55632742581E-04 3.69175844312E-04
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3.83233472432E-04 3.97825096193E-04 4.12970916481E-04 4.28691892988E-04
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4.45009772361E-04 4.61947117380E-04 4.79527337195E-04 4.97774718646E-04
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5.16714458737E-04 5.36372698255E-04 5.56776556626E-04 5.77954168010E-04
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5.99934718683E-04 6.22748485789E-04 6.46426877458E-04 6.71002474350E-04
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6.96509072703E-04 7.22981728901E-04 7.50456805618E-04 7.78972019614E-04
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8.08566491205E-04 8.39280795498E-04 8.71157015410E-04 9.04238796563E-04
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9.38571404097E-04 9.74201781484E-04 1.01117861136E-03 1.04955237851E-03
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1.08937543504E-03 1.13070206774E-03 1.17358856785E-03 1.21809330319E-03
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1.26427679277E-03 1.31220178392E-03 1.36193333210E-03 1.41353888338E-03
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1.46708835973E-03 1.52265424717E-03 1.58031168690E-03 1.64013856945E-03
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1.70221563200E-03 1.76662655888E-03 1.83345808547E-03 1.90280010545E-03
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1.97474578153E-03 2.04939165992E-03 2.12683778835E-03 2.20718783802E-03
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2.29054922940E-03 2.37703326201E-03 2.46675524844E-03 2.55983465243E-03
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2.65639523139E-03 2.75656518333E-03 2.86047729829E-03 2.96826911444E-03
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3.08008307896E-03 3.19606671373E-03 3.31637278601E-03 3.44115948422E-03
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3.57059059882E-03 3.70483570854E-03 3.84407037198E-03 3.98847632464E-03
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4.13824168159E-03 4.29356114577E-03 4.45463622207E-03 4.62167543723E-03
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4.79489456572E-03 4.97451686155E-03 5.16077329622E-03 5.35390280278E-03
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5.55415252608E-03 5.76177807928E-03 5.97704380661E-03 6.20022305247E-03
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6.43159843685E-03 6.67146213705E-03 6.92011617578E-03 7.17787271550E-03
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7.44505435907E-03 7.72199445656E-03 8.00903741823E-03 8.30653903351E-03
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8.61486679591E-03 8.93440023372E-03 9.26553124626E-03 9.60866444560E-03
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9.96421750343E-03 1.03326215028E-02 1.07143212947E-02 1.11097758585E-02
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1.15194586669E-02 1.19438580540E-02 1.23834775862E-02 1.28388364365E-02
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1.33104697598E-02 1.37989290700E-02 1.43047826181E-02 1.48286157697E-02
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1.53710313815E-02 1.59326501772E-02 1.65141111190E-02 1.71160717770E-02
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1.77392086925E-02 1.83842177357E-02 1.90518144563E-02 1.97427344247E-02
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2.04577335633E-02 2.11975884657E-02 2.19630967021E-02 2.27550771091E-02
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2.35743700625E-02 2.44218377290E-02 2.52983642974E-02 2.62048561841E-02
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2.71422422125E-02 2.81114737613E-02 2.91135248812E-02 3.01493923747E-02
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3.12200958373E-02 3.23266776553E-02 3.34702029574E-02 3.46517595155E-02
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3.58724575912E-02 3.71334297229E-02 3.84358304495E-02 3.97808359649E-02
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4.11696437000E-02 4.26034718239E-02 4.40835586618E-02 4.56111620215E-02
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4.71875584232E-02 4.88140422258E-02 5.04919246432E-02 5.22225326431E-02
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5.40072077220E-02 5.58473045472E-02 5.77441894592E-02 5.96992388259E-02
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6.17138372395E-02 6.37893755490E-02 6.59272487171E-02 6.81288534943E-02
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7.03955858989E-02 7.27288384953E-02 7.51299974584E-02 7.76004394156E-02
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8.01415280563E-02 8.27546104972E-02 8.54410133945E-02 8.82020387918E-02
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9.10389596940E-02 9.39530153559E-02 9.69454062768E-02 1.00017288890E-01
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1.03169769937E-01 1.06403900524E-01 1.09720669834E-01 1.13120998515E-01
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1.16605731708E-01 1.20175631725E-01 1.23831370368E-01 1.27573520887E-01
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1.31402549561E-01 1.35318806922E-01 1.39322518602E-01 1.43413775815E-01
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1.47592525477E-01 1.51858559969E-01 1.56211506548E-01 1.60650816429E-01
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1.65175753535E-01 1.69785382953E-01 1.74478559100E-01 1.79253913638E-01
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1.84109843160E-01 1.89044496685E-01 1.94055762999E-01 1.99141257898E-01
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2.04298311363E-01 2.09523954745E-01 2.14814908016E-01 2.20167567151E-01
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2.25577991726E-01 2.31041892820E-01 2.36554621300E-01 2.42111156611E-01
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2.47706096167E-01 2.53333645463E-01 2.58987609048E-01 2.64661382481E-01
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2.70347945431E-01 2.76039856063E-01 2.81729246893E-01 2.87407822272E-01
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2.93066857684E-01 2.98697201064E-01 3.04289276314E-01 3.09833089245E-01
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3.15318236139E-01 3.20733915165E-01 3.26068940856E-01 3.31311761885E-01
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3.36450482347E-01 3.41472886781E-01 3.46366469136E-01 3.51118465907E-01
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3.55715893614E-01 3.60145590823E-01 3.64394264872E-01 3.68448543427E-01
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3.72295030999E-01 3.75920370480E-01 3.79311309752E-01 3.82454773343E-01
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3.85337939085E-01 3.87948319636E-01 3.90273848686E-01 3.92302971570E-01
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3.94024739949E-01 3.95428910100E-01 3.96506044287E-01 3.97247614535E-01
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3.97646108053E-01 3.97695133383E-01 3.97389526266E-01 3.96725454008E-01
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3.95700517061E-01 3.94313846299E-01 3.92566194393E-01 3.90460019455E-01
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3.87999559028E-01 3.85190892314E-01 3.82041988384E-01 3.78562738006E-01
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3.74764966574E-01 3.70662425557E-01 3.66270759780E-01 3.61607447840E-01
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3.56691712922E-01 3.51544401358E-01 3.46187826339E-01 3.40645574356E-01
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3.34942272182E-01 3.29103312484E-01 3.23154536593E-01 3.17121873384E-01
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3.11030933875E-01 3.04906561824E-01 2.98772341423E-01 2.92650064172E-01
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2.86559158059E-01 2.80516083421E-01 2.74533701162E-01 2.68620620519E-01
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2.62780535113E-01 2.57012662107E-01 2.51316600156E-01 2.45692512413E-01
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2.40140541519E-01 2.34660810952E-01 2.29253426275E-01 2.23918476283E-01
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2.18656034050E-01 2.13466157874E-01 2.08348892123E-01 2.03304574649E-01
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1.98332921663E-01 1.93433940023E-01 1.88607625001E-01 1.83853960587E-01
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1.79172919693E-01 1.74564464247E-01 1.70028545164E-01 1.65565102214E-01
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1.61174063773E-01 1.56855346464E-01 1.52608854695E-01 1.48434480095E-01
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1.44332100850E-01 1.40301580953E-01 1.36342769374E-01 1.32455499168E-01
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1.28639586512E-01 1.24894829717E-01 1.21221008200E-01 1.17617881451E-01
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1.14085188014E-01 1.10622644480E-01 1.07229944533E-01 1.03906758046E-01
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1.00652730267E-01 9.74674810875E-02 9.43506044263E-02 9.13016677328E-02
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8.83202116233E-02 8.54057496604E-02 8.25577682803E-02 7.97757268756E-02
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7.70590580323E-02 7.44071679225E-02 7.18194368496E-02 6.92952199395E-02
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6.68338479724E-02 6.44346283431E-02 6.20968461405E-02 5.98197653326E-02
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5.76026300414E-02 5.54446658945E-02 5.33450814349E-02 5.13030695736E-02
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4.93178090664E-02 4.73884659994E-02 4.55141952646E-02 4.36941420103E-02
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4.19274430502E-02 4.02132282174E-02 3.85506216493E-02 3.69387429933E-02
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3.53767085220E-02 3.38636321519E-02 3.23986263586E-02 3.09808029865E-02
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2.96092739509E-02 2.82831518351E-02 2.70015503841E-02 2.57635849029E-02
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2.45683725639E-02 2.34150326362E-02 2.23026866434E-02 2.12304584654E-02
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2.01974743928E-02 1.92028631503E-02 1.82457558992E-02 1.73252862327E-02
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1.64405901761E-02 1.55908062026E-02 1.47750752740E-02 1.39925409167E-02
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1.32423493386E-02 1.25236495930E-02 1.18355937940E-02 1.11773373855E-02
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1.05480394656E-02 9.94686316425E-03 9.37297607557E-03 8.82555073846E-03
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8.30376516445E-03 7.80680340661E-03 7.33385616466E-03 6.88412142024E-03
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6.45680509605E-03 6.05112173239E-03 5.66629517446E-03 5.30155926388E-03
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4.95615852798E-03 4.62934886063E-03 4.32039818885E-03 4.02858711957E-03
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3.75320956150E-03 3.49357331756E-03 3.24900064358E-03 3.01882876992E-03
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2.80241038262E-03 2.59911406166E-03 2.40832467420E-03 2.22944372115E-03
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2.06188963601E-03 1.90509803519E-03 1.75852191959E-03 1.62163182759E-03
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1.49391593980E-03 1.37488013651E-03 1.26404800889E-03 1.16096082526E-03
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1.06517745411E-03 9.76274245615E-04 8.93844873742E-04 8.17500140916E-04
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7.46867747652E-04 6.81592029440E-04 6.21333663304E-04 5.65769346526E-04
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5.14591450030E-04 4.67507648929E-04 4.24240532733E-04 3.84527197695E-04
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3.48118823728E-04 3.14780238253E-04 2.84289469305E-04 2.56437290121E-04
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2.31026757352E-04 2.07872744959E-04 1.86801475739E-04 1.67650052324E-04
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1.50265989392E-04 1.34506748707E-04 1.20239278484E-04 1.07339558476E-04
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9.56921520425E-05 8.51897663429E-05 7.57328216863E-05 6.72290309475E-05
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5.95929897738E-05 5.27457785665E-05 4.66148420206E-05 4.11357212179E-05
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3.62465457475E-05 3.18902723730E-05 2.80146568247E-05 2.45719223957E-05
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2.15184448645E-05 1.88144534681E-05 1.64237476156E-05 1.43134289995E-05
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1.24536487314E-05 1.08173690986E-05 9.38013951561E-06 8.11988621890E-06
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7.01671523866E-06 6.05272816151E-06 5.21185018783E-06 4.47966997675E-06
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3.84329076495E-06 3.29119224173E-06 2.81310266104E-06 2.39988067263E-06
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2.04340635818E-06 1.73648096364E-06 1.47273482751E-06 1.24654301409E-06
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1.05294817283E-06 8.87590157004E-07 7.46641950450E-07 6.26751465801E-07
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5.24988794588E-07 4.38798506738E-07 3.65956615007E-07 3.04531838265E-07
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2.52850816313E-07 2.09466947786E-07 1.73132541694E-07 1.42773991976E-07
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1.17469703212E-07 9.64305140520E-08 7.89823830977E-08 6.45511197355E-08
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5.26489598441E-08 4.28628033393E-08 3.48439472545E-08 2.82991645710E-08
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2.29829954488E-08 1.86163085134E-08 1.50390259038E-08 1.21163037408E-08
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9.73486244099E-09 7.79979951612E-09 6.23182941773E-09 4.96490018850E-09
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3.94414155453E-09 3.12410363871E-09 2.46724969491E-09 1.94267016179E-09
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1.52498892315E-09 1.19343594781E-09 9.31063479566E-10 7.24085669494E-10
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5.61324004516E-10 4.33743102078E-10 3.34063428132E-10 2.56439269778E-10
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1.96191871398E-10 1.49589039821E-10 1.13663755498E-10 8.60654078594E-11
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6.49382183252E-11 4.88222374996E-11 3.65730165944E-11 2.72966691840E-11
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2.02975689594E-11 1.50363824809E-11 1.10965223232E-11 8.15743394272E-12
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5.97340670686E-12 4.35683268439E-12 3.16503210211E-12 2.28992726570E-12
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1.64998199117E-12 1.18393539209E-12 8.45950866578E-13 6.01876490918E-13
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4.26374479980E-13 3.00727255586E-13 2.11167963491E-13 1.47615686370E-13
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1.02721536647E-13 7.11524724106E-14 4.90560565375E-14 3.36622983396E-14
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2.29888586923E-14 1.56238215314E-14 1.05663917816E-14 7.11064123009E-15
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4.76108724599E-15 3.17169331163E-15 2.10201551723E-15 1.38583649958E-15
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9.08846892271E-16 5.92847590384E-16 3.84626831622E-16 2.48170695603E-16
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1.59237615036E-16 1.01600195254E-16 6.44564253288E-17 4.06564432575E-17
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2.54948432375E-17 1.58928949982E-17 9.84801934354E-18 6.06536696261E-18
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3.71273768287E-18 2.25853443278E-18 1.36527544145E-18 8.20050072161E-19
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4.89386494652E-19 2.90148047031E-19 1.70886394895E-19 9.99721749384E-20
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5.80895224479E-20 3.35217142596E-20 1.92099683411E-20 1.09310250276E-20
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6.17575777613E-21 3.46398158903E-21 1.92875556129E-21 1.06599445119E-21
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5.84747227311E-22 3.18328630163E-22 1.71963328562E-22 9.21735653385E-23
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4.90167587825E-23 2.58587290703E-23 1.35316364961E-23 7.02311305764E-24
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3.61493305730E-24 1.84508606896E-24 9.33754501903E-25 4.68491650446E-25
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2.33011225019E-25 1.14870854927E-25 5.61244975982E-26
|
|
3D 2 5.00 Wavefunction
|
|
1.25715806928E-14 1.30519658974E-14 1.35507075800E-14 1.40685071783E-14
|
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1.46060929335E-14 1.51642209140E-14 1.57436760793E-14 1.63452733837E-14
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1.69698589226E-14 1.76183111223E-14 1.82915419757E-14 1.89904983245E-14
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1.97161631913E-14 2.04695571619E-14 2.12517398207E-14 2.20638112411E-14
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2.29069135322E-14 2.37822324457E-14 2.46909990430E-14 2.56344914268E-14
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2.66140365390E-14 2.76310120261E-14 2.86868481777E-14 2.97830299372E-14
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3.09210989909E-14 3.21026559361E-14 3.33293625318E-14 3.46029440364E-14
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4S 0 1.00 Wavefunction
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2.15847653046E-04 1.85313766233E-04 1.58772050583E-04 1.35749277390E-04
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|
1.15821461181E-04 9.86096426336E-05 8.37759191510E-05 7.10197224531E-05
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|
6.00743405348E-05 5.07036795565E-05 4.26992596966E-05 3.58774376832E-05
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|
3.00768476390E-05 2.51560509934E-05 2.09913855414E-05 1.74750032344E-05
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|
1.45130859598E-05 1.20242283953E-05 9.93797698205E-06 8.19351414361E-06
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|
6.73847705957E-06 5.52790057409E-06 4.52327416378E-06 3.69170329217E-06
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|
3.00516592685E-06 2.43985547916E-06 1.97560193326E-06 1.59536345275E-06
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|
1.28478128018E-06 1.03179127001E-06 8.26285913463E-07 6.59821218067E-07
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|
5.25363290798E-07 4.17069947076E-07 3.30106858058E-07 2.60511295318E-07
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|
2.04981222232E-07 1.60805460217E-07 1.25768007319E-07 9.80630784982E-08
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|
7.62236764723E-08 5.90617280947E-08 4.56180741123E-08 3.51208256424E-08
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|
2.69508011171E-08 2.06129348191E-08 1.57127044982E-08 1.19367628495E-08
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|
9.03707770169E-09 6.81799033539E-09 5.12569206390E-09 3.83969758275E-09
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|
2.86596102515E-09 2.13133844456E-09 1.57914975636E-09 1.16563507715E-09
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|
8.57135866425E-10 6.27861164131E-10 4.58124301644E-10 3.32956423867E-10
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2.41020601426E-10 1.73764760957E-10 1.24763581006E-10 8.92092897869E-11
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6.35193050112E-11 4.50351712841E-11 3.17925303323E-11 2.23461184213E-11
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1.56372054339E-11 1.08936237766E-11 7.55471018046E-12 5.21520565465E-12
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3.58351610780E-12 2.45080068301E-12 1.66818575430E-12 1.13004791637E-12
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7.61808113877E-13 5.11062668902E-13 3.41170498177E-13 2.26639275588E-13
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1.49822544140E-13 9.85276959904E-14 6.44540663259E-14 4.19396242493E-14
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2.71426412335E-14 1.74704461099E-14 1.11828138173E-14 7.11810549023E-15
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4.50521397415E-15 2.83515309180E-15 1.77387067661E-15 1.10339074123E-15
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6.82310591036E-16 4.19443923666E-16 2.56339702747E-16 1.55757653064E-16
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9.41169786716E-17 5.65790046732E-17 3.38650161429E-17 2.02100185034E-17
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1.20553748230E-17 7.14349189952E-18 4.20455343071E-18 2.45794334511E-18
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1.42701738930E-18 8.22724311223E-19 4.70986929373E-19 2.67703561518E-19
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1.51060542086E-19 8.46174353931E-20 4.70479217888E-20 2.59628359434E-20
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1.42184984317E-20 7.72686928792E-21 4.16638504936E-21 2.22883799154E-21
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1.18281704348E-21 6.22633940904E-22 3.25072158677E-22 1.68311422210E-22
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8.64149203659E-23 4.39905240993E-23 2.22012867021E-23 1.11070448242E-23
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5.50772748593E-24 2.70677073413E-24 1.31821597369E-24 6.36103933987E-25
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3.04106516971E-25 1.44021919723E-25 6.75592991186E-26 3.13865187110E-26
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1.44394209609E-26 6.57735838202E-27 2.96615703936E-27 1.32410616647E-27
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5.85035131239E-28 2.55808689829E-28 1.10679166875E-28 4.73779238503E-29
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2.00626047031E-29 8.40312085055E-30 3.48077553337E-30 1.42571559562E-30
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5.77364204143E-31 2.31134463370E-31 9.14564832316E-32 3.57631266974E-32
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1.38185701523E-32 5.27511601384E-33 1.98918887344E-33 7.40846289840E-34
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2.72471086951E-34 9.89428126838E-35 3.54690877277E-35 1.25501025167E-35
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4.38232599398E-36 1.50990633703E-36 5.13227729322E-37 1.72072288654E-37
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5.68954428089E-38 1.85495687621E-38 5.96215211487E-39 1.88889287349E-39
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5.89749809075E-40 1.81428147855E-40 5.49840936446E-41 1.64128186710E-41
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4.82458644356E-42 1.39631663869E-42 3.97804470459E-43 1.11540166165E-43
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3.07738385438E-44 8.35280974397E-45 2.22994787659E-45 5.85433518869E-46
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|
1.51108750691E-46 3.83387598689E-47 9.55936428673E-48
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|
</PP_RHOATOM>
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|
|
|
|
|
<PP_ADDINFO>
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|
3D 3 2 1.50 4.00
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|
3D 3 2 2.50 5.00
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|
4S 1 0 0.50 1.00
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|
0 0.50
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|
0 0.50
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|
1 0.50
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|
1 0.50
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|
1 1.50
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|
1 1.50
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|
2 1.50
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|
2 1.50
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|
2 2.50
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|
2 2.50
|
|
-7.00000000 100.00000000 28.00000000 0.01250000
|
|
</PP_ADDINFO>
|