64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=54363419534.19382 stress="-1561163.9013957528 -1608922.1410872974 703032.0636263378 -1608922.1410872974 -4229150.679443989 1665896.9598169506 703032.0636263378 1665896.9598169506 -1131249.8308422335" free_energy=54363419534.19382 pbc="F F F" Nb 35.22086729 34.98310996 34.77096654 -36657.90932784 -19027.82881937 -56589.86861587 Nb 36.15142137 35.46613003 36.20749331 36653.55281072 19023.06809350 56587.56363146 Nb 36.75431425 37.44129990 35.60036573 1.77067524 4.55494916 -1.69698324 Nb 38.87984060 39.09037817 35.88825657 28224506.24638469 -21804884.35949506 -66620043.10736313 Nb 37.41678903 35.26474238 38.05367650 -3501148791.54305506 -2164544102.18694067 -231813364.92338404 Nb 38.64883313 36.02643917 38.13525096 3494897430.35342693 2157551176.75092506 234001239.48613530 Nb 35.14285122 37.84251291 37.57750072 -2.35373452 -1.00187578 -1.63449863 Nb 36.55604684 39.07636534 38.99475015 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40.92001145 43.77154212 38.73178244 5.46916421 11.08484042 7.16594167 Nb 35.22846722 35.45596837 39.72246587 -14790762667.74254036 -3798651451.01124763 -19426330728.48702621 Nb 36.06489388 35.67078443 40.82103674 14790762663.31800652 3798651451.33335733 19426330727.89254761 Nb 37.00297454 37.99791377 39.62151619 94224162039.89404297 -227366069687.45108032 132138832738.95942688 Nb 38.46580120 38.83299592 41.63161391 -185973473138.68002319 -85944539626.45600891 180616077847.23199463 Nb 37.56359074 34.91760722 42.27720838 -2.06765274 -2.84498544 0.18865469 Nb 39.14868815 36.00543249 43.16467589 -443899868242.49902344 -983827187098.63073730 326895448592.28680420 Nb 34.71205005 37.61558480 42.34129897 3.15639322 -0.33707659 -1.99674571 Nb 36.02411905 39.38776361 43.25429921 -77171619910.66307068 -70528259224.18527222 -6758838901.88166046 Nb 39.96522220 35.47572190 39.99951024 -273543818.90717977 -38812444.69673917 -241139936.21248627 Nb 41.10124752 35.63690967 41.00096250 273527004.69757825 38826969.99240036 241111298.15622509 Nb 42.73576697 36.97093280 39.74711659 -2211504.31384092 1412986.79184655 2164848.65852100 Nb 43.12124173 38.69249055 40.58663623 39.68239138 178.16883188 85.78923114 Nb 41.93527272 34.91626632 42.42160774 16814.70242928 -14529.83950110 28641.40583912 Nb 43.80707935 36.04557337 43.66317678 0.84916735 0.61694300 0.56018575 Nb 39.65384209 37.12501871 42.79267190 443899868245.42425537 983827187096.02209473 -326895448588.18273926 Nb 40.96140852 39.01259006 43.47886356 -30462.65851022 -24769.30429120 14801.88260269 Nb 35.03896203 39.71591458 39.85658644 -3941.20922022 1654.52188235 2232.81198833 Nb 35.63168638 41.39513319 40.94088667 2.86190494 2.38297024 2.71669340 Nb 37.87748365 42.62502432 39.58353145 -62881.05283969 -16442.37504697 -93166.38421559 Nb 38.85397112 42.88034279 41.03026787 62881.69179387 16445.38088071 93169.83150410 Nb 37.02170726 40.29947390 43.34166990 77171619902.72659302 70528259223.84033203 6758838903.14215088 Nb 38.99424783 41.10178451 43.50468863 2.21160195 1.29138380 3.96662277 Nb 34.83374092 42.87917809 42.24281412 2.75930673 3.72353995 4.49316103 Nb 36.85278579 43.52874800 43.20732235 -0.88490492 -3.40893059 -5.98894650 Nb 39.36848295 39.25015524 40.75493599 185973473129.10980225 85944539618.14869690 -180616077852.01144409 Nb 40.48799452 40.83005246 41.41951041 -2612918.26193022 -23231650.30559985 -14599781.75023175 Nb 42.66338558 42.74930166 39.63514907 1.20630921 1.23483742 6.10331529 Nb 43.60759406 43.41780347 41.70583576 -4.08023110 -3.57903838 -0.32139964 Nb 42.26370276 40.07147501 42.84618791 9298.46718684 1981.24370891 -31485.12254192 Nb 43.34254723 41.23290373 43.69659652 21169.23012987 22791.07410346 16685.90336236 Nb 40.63969217 42.17880366 42.26712404 2612931.54155405 23231663.92360772 14599782.55590150 Nb 41.72717582 44.05424298 43.83525143 1.66065304 0.22918593 -0.91880933