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 -3.7128502657e+02 1.3786618531e+05 -6.0260783346e+02 2.3132280689e+02 -3.9016991562e+02 -5.1447884668e+01 -2.3929814248e+02 7.8308109310e+01 1.3106490000e+06 1.3700113688e+00 9.7681714114e-01
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1 -3.7127349092e+02 1.3785747699e+05 -6.0255300955e+02 2.3127951863e+02 -3.9021397155e+02 -5.1397803821e+01 -2.3929814248e+02 7.8356908301e+01 1.3106850000e+06 1.3949189205e+00 9.7683044273e-01
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2 -3.7127814368e+02 1.3786093467e+05 -6.0279842854e+02 2.3152028486e+02 -3.9040583338e+02 -5.1519040818e+01 -2.3929814248e+02 7.8424588134e+01 1.3116770000e+06 1.4185164273e+00 9.7682639371e-01
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3 -3.7128684396e+02 1.3786748621e+05 -6.0270182437e+02 2.3141498041e+02 -3.9032608222e+02 -5.1496911380e+01 -2.3929814248e+02 7.8419311704e+01 1.3202440000e+06 1.5616067629e+00 9.7682448312e-01
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4 -3.7128267984e+02 1.3786435058e+05 -6.0252488418e+02 2.3124220434e+02 -3.9007037573e+02 -5.1430605049e+01 -2.3929814248e+02 7.8274239072e+01 1.3319220000e+06 1.5622276105e+00 9.7684251776e-01
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5 -3.7129151431e+02 1.3787092893e+05 -6.0236895121e+02 2.3107743690e+02 -3.8986602979e+02 -5.1351406299e+01 -2.3929814248e+02 7.8146627354e+01 1.3233730000e+06 1.5468632150e+00 9.7687524666e-01
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6 -3.7128924149e+02 1.3786920041e+05 -6.0228149766e+02 2.3099225617e+02 -3.8986049774e+02 -5.1299408437e+01 -2.3929814248e+02 7.8176550989e+01 1.3164470000e+06 1.5512797832e+00 9.7688439411e-01
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7 -3.7129515968e+02 1.3787374078e+05 -6.0272679775e+02 2.3143163808e+02 -3.9035078732e+02 -5.1464667087e+01 -2.3929814248e+02 7.8386799126e+01 1.3181540000e+06 1.5589292869e+00 9.7687017726e-01
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8 -3.7129164908e+02 1.3787109197e+05 -6.0264376221e+02 2.3135211313e+02 -3.9036194668e+02 -5.1376451084e+01 -2.3929814248e+02 7.8392778028e+01 1.3147180000e+06 1.5297618620e+00 9.7688397796e-01
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9 -3.7128264733e+02 1.3786432042e+05 -6.0257413656e+02 2.3129148923e+02 -3.9015529513e+02 -5.1417696025e+01 -2.3929814248e+02 7.8296997070e+01 1.3161520000e+06 1.5323841926e+00 9.7686807920e-01
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10 -3.7128883921e+02 1.3786905904e+05 -6.0236111832e+02 2.3107227911e+02 -3.8996298375e+02 -5.1289012725e+01 -2.3929814248e+02 7.8189020629e+01 1.3188660000e+06 1.5553485546e+00 9.7684431365e-01
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11 -3.7128710413e+02 1.3786762665e+05 -6.0253082150e+02 2.3124371737e+02 -3.9012509366e+02 -5.1386349271e+01 -2.3929814248e+02 7.8278763905e+01 1.3156440000e+06 1.5725278538e+00 9.7684252528e-01
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12 -3.7128371554e+02 1.3786530901e+05 -6.0231461434e+02 2.3103089880e+02 -3.8986304380e+02 -5.1326550021e+01 -2.3929814248e+02 7.8173121957e+01 1.3210020000e+06 1.5516828690e+00 9.7685440898e-01
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13 -3.7129340980e+02 1.3787213511e+05 -6.0235291507e+02 2.3105950527e+02 -3.8985462414e+02 -5.1332312409e+01 -2.3929814248e+02 7.8132163955e+01 1.3191190000e+06 1.5542387236e+00 9.7691056377e-01
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14 -3.7129453060e+02 1.3787315166e+05 -6.0226463996e+02 2.3097010936e+02 -3.8990748277e+02 -5.1214241204e+01 -2.3929814248e+02 7.8155226489e+01 1.3232830000e+06 1.5733381584e+00 9.7690050597e-01
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15 -3.7128469672e+02 1.3786584366e+05 -6.0232299250e+02 2.3103829578e+02 -3.9005784963e+02 -5.1171002589e+01 -2.3929814248e+02 7.8204002196e+01 1.3224160000e+06 1.5444024391e+00 9.7691683572e-01
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16 -3.7128022281e+02 1.3786267081e+05 -6.0282731556e+02 2.3154709276e+02 -3.9041951557e+02 -5.1542805605e+01 -2.3929814248e+02 7.8433148087e+01 1.3202870000e+06 1.5848383419e+00 9.7683687733e-01
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17 -3.7128588960e+02 1.3786703981e+05 -6.0242523828e+02 2.3113934868e+02 -3.9007050279e+02 -5.1303980379e+01 -2.3929814248e+02 7.8247387362e+01 1.3156320000e+06 1.5017188359e+00 9.7686217882e-01
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18 -3.7129339554e+02 1.3787228163e+05 -6.0243772664e+02 2.3114433110e+02 -3.9005602804e+02 -5.1305064341e+01 -2.3929814248e+02 7.8221508220e+01 1.3128390000e+06 1.4679649509e+00 9.7686871356e-01
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19 -3.7128198492e+02 1.3786375400e+05 -6.0234297179e+02 2.3106098687e+02 -3.8979530643e+02 -5.1395936125e+01 -2.3929814248e+02 7.8146413240e+01 1.3165970000e+06 1.5298809670e+00 9.7686424590e-01
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20 -3.7127228405e+02 1.3785654895e+05 -6.0247609672e+02 2.3120381267e+02 -3.9006151262e+02 -5.1352169481e+01 -2.3929814248e+02 7.8235727861e+01 1.3145710000e+06 1.4940332994e+00 9.7685594447e-01
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21 -3.7129213255e+02 1.3787137681e+05 -6.0245636087e+02 2.3116422832e+02 -3.8998215245e+02 -5.1363795513e+01 -2.3929814248e+02 7.8187729569e+01 1.3156860000e+06 1.5506519042e+00 9.7688407770e-01
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22 -3.7128618103e+02 1.3786700470e+05 -6.0247976594e+02 2.3119358491e+02 -3.9000452825e+02 -5.1393996320e+01 -2.3929814248e+02 7.8216901106e+01 1.3174870000e+06 1.5715048090e+00 9.7685964050e-01
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23 -3.7128990290e+02 1.3786992919e+05 -6.0240703689e+02 2.3111713399e+02 -3.9002417475e+02 -5.1300121167e+01 -2.3929814248e+02 7.8215401498e+01 1.3156620000e+06 1.5208659992e+00 9.7687082167e-01
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24 -3.7128262146e+02 1.3786434529e+05 -6.0265861665e+02 2.3137599519e+02 -3.9020167353e+02 -5.1458973771e+01 -2.3929814248e+02 7.8300173132e+01 1.3109010000e+06 1.4964754302e+00 9.7686201101e-01
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25 -3.7128533503e+02 1.3786636197e+05 -6.0267833571e+02 2.3139300068e+02 -3.9023021271e+02 -5.1484007545e+01 -2.3929814248e+02 7.8334027016e+01 1.3056010000e+06 1.2959181629e+00 9.7685698709e-01
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26 -3.7127209500e+02 1.3785649024e+05 -6.0273046124e+02 2.3145836624e+02 -3.9020683939e+02 -5.1573459665e+01 -2.3929814248e+02 7.8347980293e+01 1.3075080000e+06 1.2932544500e+00 9.7684617623e-01
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27 -3.7128143489e+02 1.3786327701e+05 -6.0262165451e+02 2.3134021962e+02 -3.9033530977e+02 -5.1379628647e+01 -2.3929814248e+02 7.8391426385e+01 1.3016950000e+06 1.2933507096e+00 9.7685945683e-01
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28 -3.7128365348e+02 1.3786498534e+05 -6.0265798819e+02 2.3137433471e+02 -3.9022024595e+02 -5.1456147499e+01 -2.3929814248e+02 7.8316547734e+01 1.3074550000e+06 1.3000629675e+00 9.7687550276e-01
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29 -3.7127582365e+02 1.3785920936e+05 -6.0254589157e+02 2.3127006791e+02 -3.9013592750e+02 -5.1378817311e+01 -2.3929814248e+02 7.8266995717e+01 1.3017660000e+06 1.2795281503e+00 9.7684419916e-01
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30 -3.7128111380e+02 1.3786343560e+05 -6.0252616636e+02 2.3124505257e+02 -3.9011919068e+02 -5.1421069991e+01 -2.3929814248e+02 7.8312236781e+01 1.3032390000e+06 1.3248879276e+00 9.7688119122e-01
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31 -3.7127344485e+02 1.3785776284e+05 -6.0266889396e+02 2.3139544911e+02 -3.9012261781e+02 -5.1539416322e+01 -2.3929814248e+02 7.8291282639e+01 1.3077660000e+06 1.4001886956e+00 9.7684684888e-01
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32 -3.7127781070e+02 1.3786086372e+05 -6.0254980964e+02 2.3127199894e+02 -3.9010437771e+02 -5.1402027297e+01 -2.3929814248e+02 7.8254737837e+01 1.3069940000e+06 1.4520592317e+00 9.7686156308e-01
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33 -3.7127839180e+02 1.3786140623e+05 -6.0235943935e+02 2.3108104754e+02 -3.8976242314e+02 -5.1404196250e+01 -2.3929814248e+02 7.8105322525e+01 1.3007750000e+06 1.3050767984e+00 9.7686429025e-01
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34 -3.7129406051e+02 1.3787289237e+05 -6.0241340801e+02 2.3111934749e+02 -3.8983948183e+02 -5.1462496151e+01 -2.3929814248e+02 7.8186712447e+01 1.3084780000e+06 1.3747790921e+00 9.7685579003e-01
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35 -3.7129341758e+02 1.3787240001e+05 -6.0258378158e+02 2.3129036400e+02 -3.9019255332e+02 -5.1368621748e+01 -2.3929814248e+02 7.8275535961e+01 1.3121240000e+06 1.4496954363e+00 9.7687489219e-01
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36 -3.7130096913e+02 1.3787823669e+05 -6.0265002881e+02 2.3134905968e+02 -3.9006067642e+02 -5.1523699685e+01 -2.3929814248e+02 7.8232489769e+01 1.3184360000e+06 1.5609074794e+00 9.7684937601e-01
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37 -3.7127880635e+02 1.3786152681e+05 -6.0245014479e+02 2.3117133844e+02 -3.9004646563e+02 -5.1372737841e+01 -2.3929814248e+02 7.8267201156e+01 1.3184090000e+06 1.5747265257e+00 9.7687717124e-01
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38 -3.7129613314e+02 1.3787439975e+05 -6.0269044682e+02 2.3139431368e+02 -3.9020870544e+02 -5.1510222676e+01 -2.3929814248e+02 7.8326623769e+01 1.3131770000e+06 1.4813908096e+00 9.7682633466e-01
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39 -3.7128200292e+02 1.3786386326e+05 -6.0271079651e+02 2.3142879360e+02 -3.9035285577e+02 -5.1461239253e+01 -2.3929814248e+02 7.8401440985e+01 1.3112920000e+06 1.4832357951e+00 9.7685037385e-01
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40 -3.7128417163e+02 1.3786575852e+05 -6.0268808057e+02 2.3140390894e+02 -3.9032618014e+02 -5.1438561234e+01 -2.3929814248e+02 7.8374803276e+01 1.3160380000e+06 1.5547658112e+00 9.7682967865e-01
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41 -3.7129470003e+02 1.3787323992e+05 -6.0252266294e+02 2.3122796291e+02 -3.9005691650e+02 -5.1425309969e+01 -2.3929814248e+02 7.8257706003e+01 1.3151070000e+06 1.5820400342e+00 9.7685650946e-01
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42 -3.7128341916e+02 1.3786502106e+05 -6.0236740024e+02 2.3108398108e+02 -3.8991272934e+02 -5.1340175928e+01 -2.3929814248e+02 7.8183647499e+01 1.3152000000e+06 1.6137654539e+00 9.7686514785e-01
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43 -3.7127434156e+02 1.3785822844e+05 -6.0252494229e+02 2.3125060072e+02 -3.9013991656e+02 -5.1391812200e+01 -2.3929814248e+02 7.8304928951e+01 1.3080500000e+06 1.3940557409e+00 9.7683983667e-01
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44 -3.7128699049e+02 1.3786781620e+05 -6.0257721025e+02 2.3129021977e+02 -3.9017676256e+02 -5.1405336205e+01 -2.3929814248e+02 7.8303030982e+01 1.3072190000e+06 1.3781787250e+00 9.7684635628e-01
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45 -3.7129253119e+02 1.3787153078e+05 -6.0246036898e+02 2.3116783779e+02 -3.9007367027e+02 -5.1308533441e+01 -2.3929814248e+02 7.8219977202e+01 1.3109430000e+06 1.4314723536e+00 9.7687919715e-01
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46 -3.7128002382e+02 1.3786236643e+05 -6.0176855579e+02 2.3048853197e+02 -3.9012495254e+02 -5.1329065076e+01 -2.3929814248e+02 7.8983604297e+01 1.3064610000e+06 1.3874191977e+00 9.7687695168e-01
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47 -3.7128945745e+02 1.3786938239e+05 -6.0237919613e+02 2.3108973868e+02 -3.8996551268e+02 -5.1315456116e+01 -2.3929814248e+02 7.8199915141e+01 1.3010300000e+06 1.3027313668e+00 9.7687015797e-01
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48 -3.7128461597e+02 1.3786585715e+05 -6.0233906874e+02 2.3105445277e+02 -3.8979712848e+02 -5.1398239537e+01 -2.3929814248e+02 7.8154441750e+01 1.3049620000e+06 1.2784081288e+00 9.7684835988e-01
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49 -3.7129304068e+02 1.3787224586e+05 -6.0273055742e+02 2.3143751674e+02 -3.9023670990e+02 -5.1531220181e+01 -2.3929814248e+02 7.8335515137e+01 1.3147030000e+06 1.5045556426e+00 9.7687167593e-01
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50 -3.7128733011e+02 1.3786791681e+05 -6.0270296914e+02 2.3141563903e+02 -3.9029162083e+02 -5.1461256147e+01 -2.3929814248e+02 7.8348050318e+01 1.3170950000e+06 1.5496469531e+00 9.7680656819e-01
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51 -3.7128846997e+02 1.3786866718e+05 -6.0281665378e+02 2.3152818381e+02 -3.9043513033e+02 -5.1483118496e+01 -2.3929814248e+02 7.8399737522e+01 1.3159740000e+06 1.5384025909e+00 9.7682334598e-01
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52 -3.7128601149e+02 1.3786693955e+05 -6.0283949530e+02 2.3155348381e+02 -3.9047377274e+02 -5.1514604301e+01 -2.3929814248e+02 7.8447024216e+01 1.3153980000e+06 1.4921648968e+00 9.7682513204e-01
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53 -3.7128060211e+02 1.3786267742e+05 -6.0240408348e+02 2.3112348137e+02 -3.8997589923e+02 -5.1368192066e+01 -2.3929814248e+02 7.8238150294e+01 1.3039770000e+06 1.3317492455e+00 9.7687429179e-01
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54 -3.7128454046e+02 1.3786576204e+05 -6.0232764642e+02 2.3104310596e+02 -3.8989450605e+02 -5.1297337980e+01 -2.3929814248e+02 7.8162340085e+01 1.3076400000e+06 1.3143651374e+00 9.7689767894e-01
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55 -3.7128242286e+02 1.3786419739e+05 -6.0253287837e+02 2.3125045551e+02 -3.9016497586e+02 -5.1367791608e+01 -2.3929814248e+02 7.8298031573e+01 1.3023140000e+06 1.2831105776e+00 9.7689217601e-01
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56 -3.7128973229e+02 1.3786961794e+05 -6.0251931076e+02 2.3122957846e+02 -3.9018170770e+02 -5.1364607925e+01 -2.3929814248e+02 7.8325147346e+01 1.3028140000e+06 1.3177387081e+00 9.7688200054e-01
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57 -3.7129000880e+02 1.3786991298e+05 -6.0263009349e+02 2.3134008469e+02 -3.9019892556e+02 -5.1464986393e+01 -2.3929814248e+02 7.8331960932e+01 1.3098330000e+06 1.3974249884e+00 9.7684189553e-01
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58 -3.7128609831e+02 1.3786709204e+05 -6.0254292522e+02 2.3125682691e+02 -3.9022143381e+02 -5.1382229060e+01 -2.3929814248e+02 7.8358880132e+01 1.3090370000e+06 1.3834975511e+00 9.7680001062e-01
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59 -3.7128895358e+02 1.3786915546e+05 -6.0280043067e+02 2.3151147709e+02 -3.9049663805e+02 -5.1468980079e+01 -2.3929814248e+02 7.8463329941e+01 1.3059260000e+06 1.3327737115e+00 9.7684639465e-01
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60 -3.7129259868e+02 1.3787175840e+05 -6.0249180998e+02 2.3119921130e+02 -3.9009353447e+02 -5.1405831871e+01 -2.3929814248e+02 7.8305698843e+01 1.3115960000e+06 1.4305823334e+00 9.7683559574e-01
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61 -3.7129393015e+02 1.3787288042e+05 -6.0243091283e+02 2.3113698269e+02 -3.9000775278e+02 -5.1338659576e+01 -2.3929814248e+02 7.8213642003e+01 1.3155560000e+06 1.5278926659e+00 9.7689505670e-01
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62 -3.7128712702e+02 1.3786777224e+05 -6.0276488323e+02 2.3147775621e+02 -3.9042506758e+02 -5.1443919124e+01 -2.3929814248e+02 7.8402245945e+01 1.3215530000e+06 1.5472129434e+00 9.7685723676e-01
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63 -3.7129537208e+02 1.3787382897e+05 -6.0256106213e+02 2.3126569005e+02 -3.9025927858e+02 -5.1355150799e+01 -2.3929814248e+02 7.8351509725e+01 1.3197410000e+06 2.0319868531e+00 9.7682863022e-01
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64 -3.7128954194e+02 1.3786940946e+05 -6.0245397333e+02 2.3116443139e+02 -3.9014703539e+02 -5.1290722465e+01 -2.3929814248e+02 7.8281926997e+01 1.3208850000e+06 1.5537076965e+00 9.7691172294e-01
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65 -3.7128760108e+02 1.3786796683e+05 -6.0251927605e+02 2.3123167497e+02 -3.9013319873e+02 -5.1366386428e+01 -2.3929814248e+02 7.8278451580e+01 1.3217580000e+06 1.5689670835e+00 9.7684086867e-01
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66 -3.7127730105e+02 1.3786037492e+05 -6.0242974847e+02 2.3115244743e+02 -3.9002190997e+02 -5.1348071737e+01 -2.3929814248e+02 7.8238375707e+01 1.3162170000e+06 1.5379741658e+00 9.7688684636e-01
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67 -3.7128515683e+02 1.3786635576e+05 -6.0260134089e+02 2.3131618406e+02 -3.9011949587e+02 -5.1438608960e+01 -2.3929814248e+02 7.8254906418e+01 1.3098060000e+06 1.3594911695e+00 9.7686196345e-01
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68 -3.7128542524e+02 1.3786646052e+05 -6.0250360295e+02 2.3121817771e+02 -3.9001619128e+02 -5.1426682183e+01 -2.3929814248e+02 7.8237412991e+01 1.3080830000e+06 1.3012134209e+00 9.7688761914e-01
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69 -3.7127841934e+02 1.3786113651e+05 -6.0260569272e+02 2.3132727338e+02 -3.9014983373e+02 -5.1472223808e+01 -2.3929814248e+02 7.8314507294e+01 1.3081950000e+06 1.3341174833e+00 9.7686061284e-01
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