64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=315470.3217338753 stress="-575343.7543165456 -552095.2149360308 131415.64860605611 -552095.2149360308 -1754325.444894175 387928.23989886977 131415.64860605611 387928.23989886977 -1519616.203312046" pbc="F F F" Tc 0.45120461 0.14778399 0.39221501 -39227.25669160 -31569.04274947 -49142.41248766 Tc 1.30043930 0.83038955 1.45546883 37810.94544921 32472.65327751 45267.65983232 Tc 2.36581822 2.14807705 0.11731175 278.83584554 422.15959087 -395.36166810 Tc 3.78093613 4.37830577 0.82948741 -4573.88118730 -2193.08000389 1026.43728395 Tc 1.97754676 0.13137481 3.04675413 -3161.86769698 -6709.57397448 1878.52435455 Tc 3.19365269 1.35346225 3.58928193 4987.87547665 4331.20197029 1711.26419129 Tc -0.35476688 2.07605076 1.93318940 -623.96571487 499.34881406 203.71984630 Tc 1.43902355 3.67067400 3.69776659 -2172.80171446 -3047.10404867 292.61373666 Tc 4.37504159 0.57259868 0.30947567 -11.07860342 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6.46821744 3.85302395 -15772.22166373 -28899.17964085 11943.18226738 Tc 0.00015401 7.02821650 2.56624038 -3914.02826536 -11272.52637135 -5750.79178845 Tc 0.49424756 8.49813920 3.32715116 3817.38984555 11319.29662107 5865.19968460 Tc 5.42133795 5.09290108 0.37346813 -215007.13677508 -196584.54714671 -214568.72182496 Tc 6.22936769 5.82387204 1.15740696 219271.51570549 198966.55327274 212840.86924539 Tc 7.56748036 7.33585408 -0.09107203 -744.71577684 -631.62186493 -761.17929883 Tc 8.88068158 8.48474599 0.99074236 825.77193693 721.56778725 690.42958793 Tc 7.55600455 5.09746321 2.68186512 483.86603745 4438.26010056 -6362.71589960 Tc 8.90379282 5.80913997 3.87705354 2391.91564336 869.02540918 1601.51599233 Tc 4.62603459 7.40855501 2.95639654 18882.97386280 18398.31690190 -18641.98968670 Tc 6.22455685 8.64678607 3.09554849 1219.49273715 948.03592784 95.78074601 Tc 0.72462931 0.41246365 5.47136517 -1700.72843832 -3195.81474769 -2903.32246394 Tc 1.40685604 1.70474530 6.63705139 2553.38664953 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5.00311778 2.33017944 7.01757910 -456.94590805 662.37101928 252.74232825 Tc 7.09390717 4.25796415 8.32500040 -109400.21679225 -400452.17655278 502844.41353169 Tc 0.27045343 4.41801428 5.09130093 -1705.55166936 466.53355972 1316.17792398 Tc 1.36298913 5.85643760 6.27684388 152.05639815 536.07486787 72.35922408 Tc 3.09408849 7.78688393 4.82563510 -4165.78706874 8753.35291107 6194.13369975 Tc 3.09088280 9.08607315 6.49271492 -356.81712914 1028.41658297 506.75748156 Tc 2.75516644 4.63182907 7.50332690 -317.84333941 405.97581339 1384.95975549 Tc 3.97987529 5.52071492 9.07567348 310.20904339 214.37841841 396.41144015 Tc 0.11636318 7.84629965 6.64657099 -189.89858367 82.82410282 -206.96496310 Tc 1.15133535 8.25586481 8.66017927 121.39464629 39.62614004 219.14373499 Tc 5.64365425 4.82108645 5.06649857 -144363.85756644 15266.02693645 145928.55526652 Tc 6.47239324 6.02286445 5.95255314 -19039.55628803 -15007.58821043 47724.49172619 Tc 7.14836549 6.79040059 4.79101622 24264.97845942 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