mirror of https://github.com/QMCPACK/qmcpack.git
202 lines
45 KiB
Plaintext
202 lines
45 KiB
Plaintext
# index LocalEnergy LocalEnergy_sq LocalPotential Kinetic ElecElec IonIon LocalECP NonLocalECP BlockWeight BlockCPU AcceptRatio
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0 -2.1718161736e+01 4.7302340605e+02 -4.2642869974e+01 2.0924708237e+01 -5.2914742692e+00 -2.5551327062e+01 -1.3561122620e+01 1.7610539779e+00 1.2800000000e+06 1.6748664206e+01 9.9536020508e-01
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1 -2.1710145927e+01 4.7267515613e+02 -4.2392739966e+01 2.0682594039e+01 -5.3378995002e+00 -2.5551327062e+01 -1.3233903976e+01 1.7303905724e+00 1.2800000000e+06 1.6659350211e+01 9.9538300781e-01
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2 -2.1696005556e+01 4.7206278904e+02 -4.2333568236e+01 2.0637562680e+01 -5.3383898432e+00 -2.5551327062e+01 -1.3189447424e+01 1.7455960936e+00 1.2800000000e+06 1.6642411883e+01 9.9538359375e-01
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3 -2.1693151558e+01 4.7194609157e+02 -4.2320870237e+01 2.0627718679e+01 -5.3376816840e+00 -2.5551327062e+01 -1.3155156418e+01 1.7232949271e+00 1.2800000000e+06 1.6634465907e+01 9.9538120117e-01
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4 -2.1697730774e+01 4.7213777426e+02 -4.2350539434e+01 2.0652808660e+01 -5.3405630332e+00 -2.5551327062e+01 -1.3195964257e+01 1.7373149186e+00 1.2800000000e+06 1.6638455130e+01 9.9541914063e-01
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5 -2.1696112747e+01 4.7207945221e+02 -4.2382425171e+01 2.0686312424e+01 -5.3368517052e+00 -2.5551327062e+01 -1.3244600167e+01 1.7503537633e+00 1.2800000000e+06 1.6647773632e+01 9.9540488281e-01
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6 -2.1707233701e+01 4.7256168317e+02 -4.2431509827e+01 2.0724276126e+01 -5.3397458364e+00 -2.5551327062e+01 -1.3286291140e+01 1.7458542119e+00 1.2800000000e+06 1.6644383197e+01 9.9536835938e-01
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7 -2.1705727323e+01 4.7248694007e+02 -4.2322410160e+01 2.0616682837e+01 -5.3360156923e+00 -2.5551327062e+01 -1.3178394951e+01 1.7433275454e+00 1.2800000000e+06 1.6649448812e+01 9.9539965820e-01
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8 -2.1703844315e+01 4.7240468420e+02 -4.2316685795e+01 2.0612841480e+01 -5.3449952372e+00 -2.5551327062e+01 -1.3154166895e+01 1.7338033991e+00 1.2800000000e+06 1.6643641458e+01 9.9539072266e-01
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9 -2.1704384060e+01 4.7243094838e+02 -4.2356403373e+01 2.0652019313e+01 -5.3337261299e+00 -2.5551327062e+01 -1.3211067947e+01 1.7397177661e+00 1.2800000000e+06 1.6641184677e+01 9.9540146484e-01
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10 -2.1700438727e+01 4.7226209134e+02 -4.2350116039e+01 2.0649677312e+01 -5.3226195826e+00 -2.5551327062e+01 -1.3212318188e+01 1.7361487928e+00 1.2800000000e+06 1.6645956556e+01 9.9539990234e-01
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11 -2.1709789701e+01 4.7265457755e+02 -4.2320396161e+01 2.0610606460e+01 -5.3464613398e+00 -2.5551327062e+01 -1.3166632922e+01 1.7440251626e+00 1.2800000000e+06 1.6632998824e+01 9.9538515625e-01
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12 -2.1706508964e+01 4.7252547682e+02 -4.2388906768e+01 2.0682397804e+01 -5.3380810989e+00 -2.5551327062e+01 -1.3249318579e+01 1.7498199724e+00 1.2800000000e+06 1.6645597124e+01 9.9537597656e-01
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13 -2.1713222240e+01 4.7280754047e+02 -4.2374420745e+01 2.0661198505e+01 -5.3400639394e+00 -2.5551327062e+01 -1.3227394412e+01 1.7443646678e+00 1.2800000000e+06 1.6650621059e+01 9.9536323242e-01
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14 -2.1706294093e+01 4.7251643283e+02 -4.2376291452e+01 2.0669997359e+01 -5.3305227468e+00 -2.5551327062e+01 -1.3234859719e+01 1.7404180759e+00 1.2800000000e+06 1.6657437576e+01 9.9537172852e-01
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15 -2.1702587534e+01 4.7236231672e+02 -4.2334407801e+01 2.0631820267e+01 -5.3337340853e+00 -2.5551327062e+01 -1.3186668004e+01 1.7373213508e+00 1.2800000000e+06 1.6646921552e+01 9.9538886719e-01
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16 -2.1701521225e+01 4.7231708839e+02 -4.2347750219e+01 2.0646228994e+01 -5.3274370378e+00 -2.5551327062e+01 -1.3206116443e+01 1.7371303241e+00 1.2800000000e+06 1.6640136662e+01 9.9538408203e-01
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17 -2.1710548542e+01 4.7269115843e+02 -4.2318684372e+01 2.0608135830e+01 -5.3455767973e+00 -2.5551327062e+01 -1.3172649406e+01 1.7508688928e+00 1.2800000000e+06 1.6638174575e+01 9.9537753906e-01
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18 -2.1694872817e+01 4.7203372711e+02 -4.2344756102e+01 2.0649883286e+01 -5.3328554066e+00 -2.5551327062e+01 -1.3209780741e+01 1.7492071075e+00 1.2800000000e+06 1.6625617145e+01 9.9537148438e-01
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19 -2.1695650224e+01 4.7205399295e+02 -4.2345798081e+01 2.0650147857e+01 -5.3297497475e+00 -2.5551327062e+01 -1.3216269101e+01 1.7515478294e+00 1.2800000000e+06 1.6641269240e+01 9.9540605469e-01
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20 -2.1700470386e+01 4.7225387066e+02 -4.2277863810e+01 2.0577393424e+01 -5.3450653151e+00 -2.5551327062e+01 -1.3113988677e+01 1.7325172443e+00 1.2800000000e+06 1.6632486925e+01 9.9540727539e-01
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21 -2.1700528285e+01 4.7227441817e+02 -4.2365276020e+01 2.0664747735e+01 -5.3394280706e+00 -2.5551327062e+01 -1.3190966680e+01 1.7164457925e+00 1.2800000000e+06 1.6637207875e+01 9.9536738281e-01
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22 -2.1704288684e+01 4.7243292760e+02 -4.2315539394e+01 2.0611250710e+01 -5.3393625368e+00 -2.5551327062e+01 -1.3149888343e+01 1.7250385479e+00 1.2800000000e+06 1.6635716000e+01 9.9538847656e-01
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23 -2.1698781135e+01 4.7219195575e+02 -4.2330454116e+01 2.0631672981e+01 -5.3382362599e+00 -2.5551327062e+01 -1.3183124885e+01 1.7422340916e+00 1.2800000000e+06 1.6643022938e+01 9.9539121094e-01
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24 -2.1707128474e+01 4.7254684608e+02 -4.2295218379e+01 2.0588089905e+01 -5.3397782989e+00 -2.5551327062e+01 -1.3150825432e+01 1.7467124133e+00 1.2800000000e+06 1.6631355475e+01 9.9539042969e-01
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25 -2.1699046241e+01 4.7220582761e+02 -4.2284688814e+01 2.0585642573e+01 -5.3434667883e+00 -2.5551327062e+01 -1.3127525398e+01 1.7376304346e+00 1.2800000000e+06 1.6640559974e+01 9.9539511719e-01
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26 -2.1703724425e+01 4.7239160073e+02 -4.2397989990e+01 2.0694265565e+01 -5.3420257716e+00 -2.5551327062e+01 -1.3242511725e+01 1.7378745685e+00 1.2800000000e+06 1.6649932569e+01 9.9540429688e-01
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27 -2.1699952871e+01 4.7223140264e+02 -4.2363233118e+01 2.0663280248e+01 -5.3331527681e+00 -2.5551327062e+01 -1.3221143739e+01 1.7423904516e+00 1.2800000000e+06 1.6647088859e+01 9.9538769531e-01
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28 -2.1694579512e+01 4.7201457056e+02 -4.2365967527e+01 2.0671388015e+01 -5.3335628036e+00 -2.5551327062e+01 -1.3192626589e+01 1.7115489277e+00 1.2800000000e+06 1.6648372164e+01 9.9538168945e-01
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29 -2.1701879731e+01 4.7233515664e+02 -4.2367480007e+01 2.0665600276e+01 -5.3234277326e+00 -2.5551327062e+01 -1.3225314014e+01 1.7325888018e+00 1.2800000000e+06 1.6650595450e+01 9.9533911133e-01
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30 -2.1693120593e+01 4.7194777660e+02 -4.2372372709e+01 2.0679252115e+01 -5.3232494767e+00 -2.5551327062e+01 -1.3234202876e+01 1.7364067058e+00 1.2800000000e+06 1.6646065107e+01 9.9536455078e-01
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31 -2.1699583230e+01 4.7222652254e+02 -4.2333955452e+01 2.0634372222e+01 -5.3383956762e+00 -2.5551327062e+01 -1.3193401666e+01 1.7491689520e+00 1.2800000000e+06 1.6635564075e+01 9.9540483398e-01
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32 -2.1697114226e+01 4.7212790754e+02 -4.2360085835e+01 2.0662971608e+01 -5.3372281185e+00 -2.5551327062e+01 -1.3201367822e+01 1.7298371676e+00 1.2800000000e+06 1.6639602112e+01 9.9538691406e-01
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33 -2.1696703103e+01 4.7209843803e+02 -4.2328866718e+01 2.0632163615e+01 -5.3349914527e+00 -2.5551327062e+01 -1.3150191093e+01 1.7076428896e+00 1.2800000000e+06 1.6639169064e+01 9.9537714844e-01
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34 -2.1698553403e+01 4.7219066190e+02 -4.2318987639e+01 2.0620434236e+01 -5.3414557671e+00 -2.5551327062e+01 -1.3164111165e+01 1.7379063544e+00 1.2800000000e+06 1.6635838353e+01 9.9535664063e-01
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35 -2.1699675293e+01 4.7223289228e+02 -4.2332500081e+01 2.0632824788e+01 -5.3389977781e+00 -2.5551327062e+01 -1.3165377330e+01 1.7232020896e+00 1.2800000000e+06 1.6636856670e+01 9.9539941406e-01
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36 -2.1701747492e+01 4.7231000389e+02 -4.2345563985e+01 2.0643816493e+01 -5.3403171101e+00 -2.5551327062e+01 -1.3192149745e+01 1.7382299323e+00 1.2800000000e+06 1.6638813590e+01 9.9540112305e-01
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37 -2.1705822180e+01 4.7251546371e+02 -4.2340750381e+01 2.0634928201e+01 -5.3524024026e+00 -2.5551327062e+01 -1.3166886302e+01 1.7298653854e+00 1.2800000000e+06 1.6629190811e+01 9.9539785156e-01
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38 -2.1699526195e+01 4.7221390686e+02 -4.2334561751e+01 2.0635035556e+01 -5.3471459716e+00 -2.5551327062e+01 -1.3166680245e+01 1.7305915276e+00 1.2800000000e+06 1.6628464822e+01 9.9535283203e-01
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39 -2.1698015828e+01 4.7215912073e+02 -4.2343037752e+01 2.0645021924e+01 -5.3378240742e+00 -2.5551327062e+01 -1.3175804323e+01 1.7219177077e+00 1.2800000000e+06 1.6631226519e+01 9.9538823242e-01
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40 -2.1705415497e+01 4.7246996834e+02 -4.2444016771e+01 2.0738601273e+01 -5.3471835120e+00 -2.5551327062e+01 -1.3273979680e+01 1.7284734833e+00 1.2800000000e+06 1.6646140835e+01 9.9537626953e-01
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41 -2.1702298639e+01 4.7234204176e+02 -4.2334129432e+01 2.0631830793e+01 -5.3618788487e+00 -2.5551327062e+01 -1.3125388174e+01 1.7044646530e+00 1.2800000000e+06 1.6628590751e+01 9.9538618164e-01
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42 -2.1703586949e+01 4.7240185511e+02 -4.2363333443e+01 2.0659746495e+01 -5.3428153367e+00 -2.5551327062e+01 -1.3180832447e+01 1.7116414022e+00 1.2800000000e+06 1.6625478632e+01 9.9536450195e-01
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43 -2.1703087924e+01 4.7237349913e+02 -4.2382390586e+01 2.0679302663e+01 -5.3260122813e+00 -2.5551327062e+01 -1.3242000555e+01 1.7369493116e+00 1.2800000000e+06 1.6652656964e+01 9.9537211914e-01
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44 -2.1697557015e+01 4.7213999527e+02 -4.2330553355e+01 2.0632996341e+01 -5.3320853958e+00 -2.5551327062e+01 -1.3194036218e+01 1.7468953202e+00 1.2800000000e+06 1.6631735065e+01 9.9538432617e-01
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45 -2.1701140071e+01 4.7229484405e+02 -4.2334314601e+01 2.0633174529e+01 -5.3219701611e+00 -2.5551327062e+01 -1.3210139176e+01 1.7491217983e+00 1.2800000000e+06 1.6654559889e+01 9.9538867188e-01
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46 -2.1702537674e+01 4.7235122999e+02 -4.2351262886e+01 2.0648725211e+01 -5.3338806083e+00 -2.5551327062e+01 -1.3215322659e+01 1.7492674436e+00 1.2800000000e+06 1.6651528572e+01 9.9538247070e-01
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47 -2.1705477670e+01 4.7246718939e+02 -4.2324424316e+01 2.0618946646e+01 -5.3467044354e+00 -2.5551327062e+01 -1.3170951276e+01 1.7445584579e+00 1.2800000000e+06 1.6650400408e+01 9.9541035156e-01
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48 -2.1696734963e+01 4.7209691044e+02 -4.2310474174e+01 2.0613739211e+01 -5.3340337976e+00 -2.5551327062e+01 -1.3165525003e+01 1.7404116880e+00 1.2800000000e+06 1.6635392878e+01 9.9539326172e-01
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49 -2.1702192253e+01 4.7234164348e+02 -4.2298885011e+01 2.0596692758e+01 -5.3446992436e+00 -2.5551327062e+01 -1.3141350751e+01 1.7384920462e+00 1.2800000000e+06 1.6640177718e+01 9.9542216797e-01
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50 -2.1701468326e+01 4.7231034374e+02 -4.2328838841e+01 2.0627370515e+01 -5.3381909105e+00 -2.5551327062e+01 -1.3199437604e+01 1.7601167355e+00 1.2800000000e+06 1.6641106137e+01 9.9539340820e-01
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51 -2.1696066748e+01 4.7206620340e+02 -4.2334242027e+01 2.0638175279e+01 -5.3358610745e+00 -2.5551327062e+01 -1.3177850104e+01 1.7307962133e+00 1.2800000000e+06 1.6639989980e+01 9.9538076172e-01
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52 -2.1698287220e+01 4.7215652519e+02 -4.2333244733e+01 2.0634957513e+01 -5.3513661479e+00 -2.5551327062e+01 -1.3152523518e+01 1.7219719942e+00 1.2800000000e+06 1.6646837129e+01 9.9539399414e-01
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53 -2.1703697878e+01 4.7240402118e+02 -4.2366747503e+01 2.0663049626e+01 -5.3426319790e+00 -2.5551327062e+01 -1.3213370115e+01 1.7405816524e+00 1.2800000000e+06 1.6632877393e+01 9.9533569336e-01
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54 -2.1704053011e+01 4.7240947795e+02 -4.2359204457e+01 2.0655151446e+01 -5.3496598657e+00 -2.5551327062e+01 -1.3187551988e+01 1.7293344586e+00 1.2800000000e+06 1.6633701279e+01 9.9539316406e-01
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55 -2.1696741086e+01 4.7209437751e+02 -4.2351854133e+01 2.0655113047e+01 -5.3419015286e+00 -2.5551327062e+01 -1.3204360855e+01 1.7457353122e+00 1.2800000000e+06 1.6627695574e+01 9.9536655273e-01
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56 -2.1692644673e+01 4.7193081263e+02 -4.2378526984e+01 2.0685882311e+01 -5.3392926816e+00 -2.5551327062e+01 -1.3224414087e+01 1.7365068474e+00 1.2800000000e+06 1.6633928696e+01 9.9538813477e-01
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57 -2.1703036230e+01 4.7236782631e+02 -4.2325509319e+01 2.0622473089e+01 -5.3454909336e+00 -2.5551327062e+01 -1.3169939587e+01 1.7412482636e+00 1.2800000000e+06 1.6632821194e+01 9.9542084961e-01
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58 -2.1703661724e+01 4.7239431325e+02 -4.2367208936e+01 2.0663547213e+01 -5.3552961588e+00 -2.5551327062e+01 -1.3183446727e+01 1.7228610120e+00 1.2800000000e+06 1.6630045379e+01 9.9538071289e-01
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59 -2.1703590930e+01 4.7239272321e+02 -4.2334560205e+01 2.0630969275e+01 -5.3403579976e+00 -2.5551327062e+01 -1.3177808152e+01 1.7349330065e+00 1.2800000000e+06 1.6642931537e+01 9.9537006836e-01
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60 -2.1698898909e+01 4.7218504557e+02 -4.2387832173e+01 2.0688933263e+01 -5.3293194031e+00 -2.5551327062e+01 -1.3241623010e+01 1.7344373026e+00 1.2800000000e+06 1.6638390534e+01 9.9541694336e-01
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61 -2.1704653178e+01 4.7243309461e+02 -4.2303554130e+01 2.0598900953e+01 -5.3484237103e+00 -2.5551327062e+01 -1.3155310144e+01 1.7515067862e+00 1.2800000000e+06 1.6644807352e+01 9.9539555664e-01
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62 -2.1702335582e+01 4.7234557851e+02 -4.2341592064e+01 2.0639256482e+01 -5.3345361493e+00 -2.5551327062e+01 -1.3202049927e+01 1.7463210748e+00 1.2800000000e+06 1.6648726612e+01 9.9543271484e-01
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63 -2.1695773140e+01 4.7205553856e+02 -4.2330087095e+01 2.0634313955e+01 -5.3404589881e+00 -2.5551327062e+01 -1.3170999922e+01 1.7326988772e+00 1.2800000000e+06 1.6642855922e+01 9.9538916016e-01
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64 -2.1700236894e+01 4.7225727353e+02 -4.2368314117e+01 2.0668077223e+01 -5.3391571096e+00 -2.5551327062e+01 -1.3216103685e+01 1.7382737395e+00 1.2800000000e+06 1.6649734182e+01 9.9538066406e-01
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65 -2.1710646248e+01 4.7271361578e+02 -4.2326479730e+01 2.0615833482e+01 -5.3409554910e+00 -2.5551327062e+01 -1.3189752592e+01 1.7555554156e+00 1.2800000000e+06 1.6641531366e+01 9.9538364258e-01
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66 -2.1700531323e+01 4.7225867323e+02 -4.2356590009e+01 2.0656058686e+01 -5.3348545464e+00 -2.5551327062e+01 -1.3229722908e+01 1.7593145072e+00 1.2800000000e+06 1.6644408421e+01 9.9538320313e-01
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67 -2.1700132362e+01 4.7225055306e+02 -4.2363296790e+01 2.0663164428e+01 -5.3358840349e+00 -2.5551327062e+01 -1.3236419213e+01 1.7603335204e+00 1.2800000000e+06 1.6652523676e+01 9.9541479492e-01
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68 -2.1696243568e+01 4.7208066655e+02 -4.2402241640e+01 2.0705998073e+01 -5.3236162545e+00 -2.5551327062e+01 -1.3276774368e+01 1.7494760438e+00 1.2800000000e+06 1.6646604857e+01 9.9535810547e-01
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69 -2.1706179579e+01 4.7251528939e+02 -4.2354658464e+01 2.0648478885e+01 -5.3339254962e+00 -2.5551327062e+01 -1.3196233507e+01 1.7268276017e+00 1.2800000000e+06 1.6643432848e+01 9.9538071289e-01
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70 -2.1704929362e+01 4.7245268759e+02 -4.2275838428e+01 2.0570909066e+01 -5.3432926473e+00 -2.5551327062e+01 -1.3091367431e+01 1.7101487124e+00 1.2800000000e+06 1.6634902456e+01 9.9541611328e-01
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