mirror of https://github.com/QMCPACK/qmcpack.git
402 lines
90 KiB
Plaintext
402 lines
90 KiB
Plaintext
# index LocalEnergy LocalEnergy_sq LocalPotential Kinetic LocalECP NonLocalECP IonIon ElecElec BlockWeight BlockCPU AcceptRatio
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0 -3.7114984969e+02 1.3776546566e+05 -6.0141142189e+02 2.3026157220e+02 -3.8986213326e+02 -5.0512503999e+01 -2.3929814248e+02 7.8261357843e+01 1.3107230000e+06 2.3059229515e+00 9.7711124359e-01
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1 -3.7126998486e+02 1.3785456774e+05 -6.0170849509e+02 2.3043851023e+02 -3.9003046429e+02 -5.0587813950e+01 -2.3929814248e+02 7.8207925624e+01 1.3105470000e+06 2.0817553625e+00 9.7705507312e-01
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2 -3.7129119661e+02 1.3787017511e+05 -6.0180889146e+02 2.3051769485e+02 -3.9013753814e+02 -5.0606859355e+01 -2.3929814248e+02 7.8233648510e+01 1.3106360000e+06 1.6554310154e+00 9.7707726656e-01
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3 -3.7131415613e+02 1.3788736541e+05 -6.0174144849e+02 2.3042729236e+02 -3.9004706406e+02 -5.0562536817e+01 -2.3929814248e+02 7.8166294863e+01 1.3131430000e+06 1.7694372460e+00 9.7705478069e-01
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4 -3.7131836008e+02 1.3789050109e+05 -6.0184692683e+02 2.3052856675e+02 -3.9014624246e+02 -5.0619871586e+01 -2.3929814248e+02 7.8217329693e+01 1.3199470000e+06 1.9130554628e+00 9.7707734923e-01
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5 -3.7131474790e+02 1.3788791452e+05 -6.0196677122e+02 2.3065202332e+02 -3.9025879893e+02 -5.0705076589e+01 -2.3929814248e+02 7.8295246773e+01 1.3203660000e+06 1.7224524729e+00 9.7709439665e-01
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6 -3.7130314385e+02 1.3787906811e+05 -6.0173045079e+02 2.3042730694e+02 -3.9015868218e+02 -5.0571126288e+01 -2.3929814248e+02 7.8297500155e+01 1.3096840000e+06 1.6078529637e+00 9.7708587210e-01
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7 -3.7132053089e+02 1.3789197087e+05 -6.0209708386e+02 2.3077655297e+02 -3.9052487519e+02 -5.0693217355e+01 -2.3929814248e+02 7.8419151159e+01 1.2984910000e+06 1.5219182409e+00 9.7704250118e-01
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8 -3.7130774358e+02 1.3788254112e+05 -6.0188201241e+02 2.3057426883e+02 -3.9021795790e+02 -5.0671755967e+01 -2.3929814248e+02 7.8305843937e+01 1.3004680000e+06 1.5985940099e+00 9.7706604847e-01
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9 -3.7132876930e+02 1.3789842866e+05 -6.0187770091e+02 2.3054893161e+02 -3.9010004883e+02 -5.0693916302e+01 -2.3929814248e+02 7.8214406699e+01 1.3008920000e+06 1.6246809885e+00 9.7705551690e-01
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10 -3.7130933200e+02 1.3788422349e+05 -6.0176022664e+02 2.3045089464e+02 -3.9014322542e+02 -5.0576748042e+01 -2.3929814248e+02 7.8257889299e+01 1.3045160000e+06 1.5655172803e+00 9.7706450743e-01
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11 -3.7132201511e+02 1.3789316401e+05 -6.0136383971e+02 2.3004182459e+02 -3.8974513047e+02 -5.0423244085e+01 -2.3929814248e+02 7.8102677323e+01 1.3120430000e+06 1.7363307141e+00 9.7709191764e-01
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12 -3.7133399054e+02 1.3790220959e+05 -6.0173549065e+02 2.3040150011e+02 -3.8989964193e+02 -5.0666405984e+01 -2.3929814248e+02 7.8128699737e+01 1.3149920000e+06 1.7485015467e+00 9.7705818434e-01
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13 -3.7132794707e+02 1.3789737637e+05 -6.0183516467e+02 2.3050721759e+02 -3.9033859128e+02 -5.0505581751e+01 -2.3929814248e+02 7.8307150842e+01 1.3223040000e+06 1.7658633348e+00 9.7707462506e-01
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14 -3.7132034316e+02 1.3789193222e+05 -6.0213420385e+02 2.3081386069e+02 -3.9049753463e+02 -5.0714176460e+01 -2.3929814248e+02 7.8375649714e+01 1.3212770000e+06 1.7469870672e+00 9.7703055715e-01
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15 -3.7131770576e+02 1.3789014384e+05 -6.0196428159e+02 2.3064657583e+02 -3.9025802202e+02 -5.0675161706e+01 -2.3929814248e+02 7.8267044610e+01 1.3061710000e+06 1.5129458830e+00 9.7707646000e-01
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16 -3.7131328942e+02 1.3788683922e+05 -6.0186971065e+02 2.3055642123e+02 -3.9030313547e+02 -5.0597445037e+01 -2.3929814248e+02 7.8329012332e+01 1.2995630000e+06 1.5617173444e+00 9.7706091032e-01
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17 -3.7132181700e+02 1.3789322334e+05 -6.0195287705e+02 2.3063106005e+02 -3.9029665393e+02 -5.0685071697e+01 -2.3929814248e+02 7.8326991053e+01 1.2965110000e+06 1.4436605610e+00 9.7708349962e-01
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18 -3.7131581671e+02 1.3788861887e+05 -6.0175409917e+02 2.3043828245e+02 -3.9032915274e+02 -5.0438789330e+01 -2.3929814248e+02 7.8311985374e+01 1.2954610000e+06 1.4402473662e+00 9.7709930032e-01
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19 -3.7132458258e+02 1.3789516132e+05 -6.0205378752e+02 2.3072920494e+02 -3.9043732889e+02 -5.0692882079e+01 -2.3929814248e+02 7.8374565929e+01 1.2977670000e+06 1.5387479775e+00 9.7709941903e-01
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20 -3.7132030847e+02 1.3789191317e+05 -6.0176167483e+02 2.3044136636e+02 -3.9017887705e+02 -5.0544979692e+01 -2.3929814248e+02 7.8260324392e+01 1.3080830000e+06 1.5873543713e+00 9.7709181039e-01
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21 -3.7132110250e+02 1.3789229256e+05 -6.0186255552e+02 2.3054145302e+02 -3.9015470851e+02 -5.0654558502e+01 -2.3929814248e+02 7.8244853969e+01 1.3085210000e+06 1.5819015745e+00 9.7707922355e-01
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22 -3.7130538105e+02 1.3788083717e+05 -6.0172269388e+02 2.3041731283e+02 -3.8996062983e+02 -5.0603232068e+01 -2.3929814248e+02 7.8139310495e+01 1.3016920000e+06 1.4699323103e+00 9.7708119445e-01
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23 -3.7131267585e+02 1.3788615053e+05 -6.0200661955e+02 2.3069394370e+02 -3.9031256525e+02 -5.0701632612e+01 -2.3929814248e+02 7.8305720788e+01 1.2998130000e+06 1.4797321595e+00 9.7712046440e-01
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24 -3.7133102063e+02 1.3789984786e+05 -6.0188199451e+02 2.3055097389e+02 -3.9023555241e+02 -5.0606853886e+01 -2.3929814248e+02 7.8258554261e+01 1.3054390000e+06 1.4811076056e+00 9.7706462847e-01
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25 -3.7132698503e+02 1.3789715841e+05 -6.0180227875e+02 2.3047529373e+02 -3.9009121156e+02 -5.0642215978e+01 -2.3929814248e+02 7.8229291255e+01 1.3098320000e+06 1.5158132166e+00 9.7707580039e-01
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26 -3.7130541916e+02 1.3788096579e+05 -6.0221063523e+02 2.3090521607e+02 -3.9062670867e+02 -5.0736441621e+01 -2.3929814248e+02 7.8450657538e+01 1.3106440000e+06 1.5436687153e+00 9.7706144223e-01
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27 -3.7132386621e+02 1.3789436951e+05 -6.0201570762e+02 2.3069184141e+02 -3.9043334630e+02 -5.0667212961e+01 -2.3929814248e+02 7.8382994112e+01 1.3061790000e+06 1.4423594419e+00 9.7703449213e-01
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28 -3.7132746245e+02 1.3789721273e+05 -6.0182329993e+02 2.3049583748e+02 -3.9019467803e+02 -5.0620468271e+01 -2.3929814248e+02 7.8289988848e+01 1.3093770000e+06 1.4924710449e+00 9.7704427838e-01
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29 -3.7132402703e+02 1.3789474944e+05 -6.0163894660e+02 2.3031491956e+02 -3.8976421379e+02 -5.0634046534e+01 -2.3929814248e+02 7.8057456207e+01 1.3219390000e+06 1.7381564751e+00 9.7709082210e-01
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30 -3.7131393594e+02 1.3788718557e+05 -6.0178276125e+02 2.3046882531e+02 -3.8984588940e+02 -5.0714652475e+01 -2.3929814248e+02 7.8075923097e+01 1.3202300000e+06 1.6750536188e+00 9.7704443726e-01
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31 -3.7133181827e+02 1.3790061211e+05 -6.0166209528e+02 2.3033027701e+02 -3.8983901357e+02 -5.0607822083e+01 -2.3929814248e+02 7.8082882844e+01 1.3171540000e+06 1.6940849125e+00 9.7707686467e-01
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32 -3.7133051938e+02 1.3789953326e+05 -6.0150214702e+02 2.3017162764e+02 -3.8967107085e+02 -5.0555573454e+01 -2.3929814248e+02 7.8022639757e+01 1.3244790000e+06 1.7776420750e+00 9.7704898313e-01
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33 -3.7131697238e+02 1.3788925403e+05 -6.0150945882e+02 2.3019248644e+02 -3.8975681529e+02 -5.0463007903e+01 -2.3929814248e+02 7.8008506841e+01 1.3231530000e+06 1.6994988173e+00 9.7710845269e-01
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34 -3.7131179846e+02 1.3788554705e+05 -6.0169761341e+02 2.3038581496e+02 -3.9000238298e+02 -5.0577286166e+01 -2.3929814248e+02 7.8180198207e+01 1.3133140000e+06 1.6399049293e+00 9.7707390509e-01
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35 -3.7131960170e+02 1.3789137196e+05 -6.0158680292e+02 2.3026720123e+02 -3.8987296457e+02 -5.0525306347e+01 -2.3929814248e+02 7.8109610470e+01 1.3159570000e+06 1.6916691642e+00 9.7707959144e-01
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36 -3.7131797858e+02 1.3789023950e+05 -6.0173853971e+02 2.3042056113e+02 -3.8996540396e+02 -5.0650595994e+01 -2.3929814248e+02 7.8175602721e+01 1.3237940000e+06 1.7334160469e+00 9.7705378758e-01
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37 -3.7130924509e+02 1.3788363815e+05 -6.0189767396e+02 2.3058842887e+02 -3.9011938549e+02 -5.0701291163e+01 -2.3929814248e+02 7.8221145170e+01 1.3190990000e+06 1.7058273330e+00 9.7709228564e-01
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38 -3.7132287556e+02 1.3789366460e+05 -6.0180296938e+02 2.3048009383e+02 -3.9016802535e+02 -5.0562295851e+01 -2.3929814248e+02 7.8225494290e+01 1.3176820000e+06 1.7278122678e+00 9.7705203366e-01
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39 -3.7132528335e+02 1.3789561010e+05 -6.0174372119e+02 2.3041843784e+02 -3.9009577015e+02 -5.0545022407e+01 -2.3929814248e+02 7.8195213835e+01 1.3141140000e+06 1.6321406830e+00 9.7708866103e-01
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40 -3.7131658871e+02 1.3788920403e+05 -6.0164583109e+02 2.3032924239e+02 -3.9010836919e+02 -5.0501550076e+01 -2.3929814248e+02 7.8262230652e+01 1.3176030000e+06 1.7290547099e+00 9.7708114682e-01
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41 -3.7132071251e+02 1.3789263965e+05 -6.0194146404e+02 2.3062075153e+02 -3.9034404371e+02 -5.0631026429e+01 -2.3929814248e+02 7.8331748573e+01 1.3187760000e+06 1.7013401650e+00 9.7705802989e-01
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42 -3.7133413741e+02 1.3790211126e+05 -6.0180279703e+02 2.3046865962e+02 -3.9006866231e+02 -5.0629934338e+01 -2.3929814248e+02 7.8193942087e+01 1.3196080000e+06 1.7440255526e+00 9.7710486900e-01
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43 -3.7132421661e+02 1.3789487723e+05 -6.0192075251e+02 2.3059653590e+02 -3.9022291868e+02 -5.0658495497e+01 -2.3929814248e+02 7.8258804139e+01 1.3250570000e+06 1.7138464563e+00 9.7706120955e-01
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44 -3.7131480205e+02 1.3788771402e+05 -6.0187179441e+02 2.3055699236e+02 -3.9010184015e+02 -5.0691198923e+01 -2.3929814248e+02 7.8219387134e+01 1.3134080000e+06 1.5990790129e+00 9.7707419028e-01
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45 -3.7131506245e+02 1.3788825053e+05 -6.0197302937e+02 2.3065796692e+02 -3.9031072844e+02 -5.0696996706e+01 -2.3929814248e+02 7.8332838247e+01 1.3112870000e+06 1.5690410100e+00 9.7705804193e-01
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46 -3.7132828899e+02 1.3789781612e+05 -6.0172253447e+02 2.3039424547e+02 -3.9020104137e+02 -5.0526517288e+01 -2.3929814248e+02 7.8303166672e+01 1.3087640000e+06 1.5341205709e+00 9.7705699883e-01
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47 -3.7133117248e+02 1.3790030558e+05 -6.0182172246e+02 2.3049054998e+02 -3.9023970855e+02 -5.0586481077e+01 -2.3929814248e+02 7.8302609641e+01 1.3104620000e+06 1.5939806532e+00 9.7708387819e-01
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48 -3.7132956156e+02 1.3789891184e+05 -6.0185822766e+02 2.3052866610e+02 -3.9023603014e+02 -5.0630586106e+01 -2.3929814248e+02 7.8306531061e+01 1.3172900000e+06 1.7366146818e+00 9.7709226010e-01
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49 -3.7131306522e+02 1.3788638548e+05 -6.0190130239e+02 2.3058823718e+02 -3.9037265009e+02 -5.0577315881e+01 -2.3929814248e+02 7.8346806050e+01 1.3153140000e+06 1.6693531983e+00 9.7705468455e-01
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50 -3.7132966711e+02 1.3789899980e+05 -6.0210411636e+02 2.3077444926e+02 -3.9046109275e+02 -5.0749494603e+01 -2.3929814248e+02 7.8404613465e+01 1.3208280000e+06 1.7763085999e+00 9.7704849302e-01
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51 -3.7132176408e+02 1.3789293701e+05 -6.0181584822e+02 2.3049408415e+02 -3.9012000009e+02 -5.0643553186e+01 -2.3929814248e+02 7.8245847524e+01 1.3117170000e+06 1.5362431575e+00 9.7706818364e-01
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52 -3.7131829368e+02 1.3789035657e+05 -6.0182404095e+02 2.3050574727e+02 -3.9030573189e+02 -5.0558493220e+01 -2.3929814248e+02 7.8338326637e+01 1.3122530000e+06 1.6263548043e+00 9.7711726639e-01
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53 -3.7130383858e+02 1.3787951927e+05 -6.0182247692e+02 2.3051863834e+02 -3.9029893212e+02 -5.0567044558e+01 -2.3929814248e+02 7.8341642230e+01 1.3085350000e+06 1.5349529274e+00 9.7708056562e-01
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54 -3.7132313650e+02 1.3789400829e+05 -6.0207166714e+02 2.3074853064e+02 -3.9042302121e+02 -5.0723828753e+01 -2.3929814248e+02 7.8373325293e+01 1.3058210000e+06 1.5020413976e+00 9.7702928632e-01
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55 -3.7131877033e+02 1.3789055469e+05 -6.0173684932e+02 2.3041807899e+02 -3.9012973754e+02 -5.0543610121e+01 -2.3929814248e+02 7.8234640818e+01 1.3048140000e+06 1.7047731336e+00 9.7709017889e-01
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56 -3.7132721889e+02 1.3789711637e+05 -6.0200169760e+02 2.3067447872e+02 -3.9040208511e+02 -5.0708245655e+01 -2.3929814248e+02 7.8406775636e+01 1.3103630000e+06 1.5276609752e+00 9.7707088412e-01
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57 -3.7130576635e+02 1.3788120270e+05 -6.0183590238e+02 2.3053013603e+02 -3.9021003247e+02 -5.0679252500e+01 -2.3929814248e+02 7.8351525060e+01 1.3082620000e+06 1.4742687326e+00 9.7703527563e-01
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58 -3.7130886905e+02 1.3788333818e+05 -6.0184852960e+02 2.3053966056e+02 -3.9014856318e+02 -5.0672659316e+01 -2.3929814248e+02 7.8270835372e+01 1.2978710000e+06 1.4286368508e+00 9.7705285686e-01
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59 -3.7132421627e+02 1.3789482343e+05 -6.0169227517e+02 2.3036805889e+02 -3.9007247433e+02 -5.0558230452e+01 -2.3929814248e+02 7.8236572089e+01 1.2982380000e+06 1.5130255204e+00 9.7708615519e-01
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60 -3.7132628453e+02 1.3789629001e+05 -6.0184027302e+02 2.3051398848e+02 -3.9021165036e+02 -5.0624676969e+01 -2.3929814248e+02 7.8294196782e+01 1.3098290000e+06 1.5764379576e+00 9.7702641966e-01
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61 -3.7130924562e+02 1.3788373649e+05 -6.0205443111e+02 2.3074518548e+02 -3.9044562393e+02 -5.0743778600e+01 -2.3929814248e+02 7.8433113901e+01 1.3006880000e+06 1.4362211768e+00 9.7703109637e-01
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62 -3.7131592649e+02 1.3788881476e+05 -6.0197631486e+02 2.3066038837e+02 -3.9035705383e+02 -5.0700717642e+01 -2.3929814248e+02 7.8379599085e+01 1.2973990000e+06 1.4956734423e+00 9.7708325977e-01
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63 -3.7130741996e+02 1.3788232572e+05 -6.0188961410e+02 2.3058219414e+02 -3.9036716957e+02 -5.0601080388e+01 -2.3929814248e+02 7.8376778335e+01 1.3027720000e+06 1.4795614351e+00 9.7707885641e-01
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64 -3.7131394645e+02 1.3788721158e+05 -6.0171160012e+02 2.3039765367e+02 -3.9010003682e+02 -5.0518594663e+01 -2.3929814248e+02 7.8205173833e+01 1.2995490000e+06 1.4872433897e+00 9.7713263737e-01
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65 -3.7131969682e+02 1.3789137513e+05 -6.0156816315e+02 2.3024846633e+02 -3.8994181613e+02 -5.0450634038e+01 -2.3929814248e+02 7.8122429497e+01 1.3035080000e+06 1.4846476931e+00 9.7709673704e-01
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66 -3.7130966758e+02 1.3788410363e+05 -6.0163292851e+02 2.3032326093e+02 -3.8992141751e+02 -5.0529315841e+01 -2.3929814248e+02 7.8115947324e+01 1.3142800000e+06 1.7135824338e+00 9.7710132049e-01
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67 -3.7132391775e+02 1.3789462309e+05 -6.0160374023e+02 2.3027982247e+02 -3.8992492747e+02 -5.0484752027e+01 -2.3929814248e+02 7.8104081747e+01 1.3113470000e+06 1.6134989057e+00 9.7712312300e-01
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68 -3.7133201809e+02 1.3790088538e+05 -6.0158576872e+02 2.3025375063e+02 -3.8982216322e+02 -5.0547827378e+01 -2.3929814248e+02 7.8082364357e+01 1.3040970000e+06 1.4564922377e+00 9.7710725322e-01
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69 -3.7131374912e+02 1.3788696420e+05 -6.0192686062e+02 2.3061311150e+02 -3.9016400508e+02 -5.0692711972e+01 -2.3929814248e+02 7.8227998913e+01 1.3074350000e+06 1.4561902955e+00 9.7710784877e-01
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