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=-2841.252149015906 stress="6759.186144432135 220.59507244520864 1683.651464421158 220.59507244520864 8662.9257634342 178.5799169909567 1683.651464421158 178.5799169909567 6924.890094391761" pbc="F F F" Pd 0.37283489 0.02776773 -0.08498691 367.03808811 523.19692120 521.92447190 Pd 1.06677778 1.01917747 0.90309958 -375.10164812 -510.21856724 -517.27520042 Pd 3.38187880 2.50944149 -0.45825548 0.17514928 -1.64836117 -3.62578097 Pd 3.45872728 3.67410853 1.55607962 -221.14973058 324.48777926 273.81357777 Pd 2.78286023 0.03668467 1.82208007 6.17953224 -4.80031617 2.19153870 Pd 3.73354112 1.41348981 3.63705157 -0.53363334 -1.22680493 -1.49800185 Pd 0.64520942 2.53369539 2.28815934 3.04528873 -7.50937918 -7.76036882 Pd 1.25641920 4.15944301 4.21070628 -402.72153745 511.24136554 141.07121295 Pd 5.25238673 -0.33367361 -0.00562967 -5.60288726 -3.08260609 -3.91672899 Pd 6.66557061 0.82623522 1.28213177 195.09546674 339.64440601 -323.36816029 Pd 7.23046186 1.93137742 0.15586879 -183.52064979 -359.58333778 366.44506536 Pd 9.09352699 3.84921501 1.01825051 -0.79058247 -0.31242585 0.02787337 Pd 6.69661427 0.03963237 3.15594097 187.20448159 143.16469267 119.72739651 Pd 7.93202446 0.85973350 4.21262830 -188.74116550 -129.77154998 -162.84267608 Pd 5.41394406 2.32016086 2.24173144 -1.95121106 4.32282603 -0.44704525 Pd 6.04814022 3.98360583 3.83041964 -118.89536535 155.85890175 125.61457895 Pd 0.28012235 4.94058052 -0.22626682 -0.34558192 0.38926500 0.47754267 Pd 1.13898356 6.62832058 1.66221134 -515.52734351 493.59086011 349.57938290 Pd 2.48578387 7.78227015 0.38456266 867.60495611 414.37766596 309.33970038 Pd 3.77153045 8.39286596 0.85421160 -861.17122422 -409.37840394 -314.01726416 Pd 2.67116535 4.84136491 2.52646854 221.66644053 -328.10535188 -273.23754468 Pd 2.90718784 7.08148819 3.05627783 1.30667281 4.21557653 -1.98361146 Pd 0.13423686 7.62245546 2.35593507 524.78092992 -477.25830915 -324.94598566 Pd 1.26481418 8.81189841 3.57669840 -22.24219892 -19.83709829 -21.24969907 Pd 4.60831425 5.08395232 -0.07095013 0.72775403 -0.17349016 -1.13169385 Pd 6.64804483 5.95270003 1.66945808 863.64082216 -1191.47844570 1212.31134069 Pd 7.61876467 7.95661874 -0.03040672 256.24816320 109.17464383 404.73630085 Pd 8.50512234 8.33435622 1.37133246 -255.70229896 -110.07480102 -404.52187282 Pd 7.20751581 5.17924184 2.46059265 -860.53530774 1187.08188453 -1225.14406862 Pd 8.34845996 6.39534720 3.95357008 -35.50187478 68.47197918 46.72002077 Pd 5.19058014 7.25058087 2.93113249 36.78696362 422.20382957 173.84179096 Pd 5.31973602 8.83901493 3.57807814 -35.37770864 -418.88946984 -170.93593569 Pd 0.38382534 -0.14970097 5.33003801 165.95914832 314.48039085 190.85953454 Pd 1.09885626 1.21350480 6.15551208 96.88830526 -118.37564011 -337.01240614 Pd 2.42036730 2.16868085 5.46291093 -269.59302312 -193.01249789 143.03440527 Pd 4.24135582 4.09836566 5.89981165 140.10600849 193.77434098 -181.35397644 Pd 2.78222308 0.11981128 7.04218853 1.21404283 -9.34203360 -1.46538206 Pd 4.29993171 1.08895030 8.35241932 91.85449558 199.25995404 -153.96516347 Pd -0.02370265 2.63219823 7.30858920 -3.01215084 1.95183487 1.19994913 Pd 1.69742692 3.76270000 8.61415287 186.92634164 359.65330672 -194.41131730 Pd 5.16850173 0.57251956 5.44281378 193.53637745 180.16842880 179.63823240 Pd 6.25047529 1.59149871 6.44866625 -265.49563752 -576.70973305 517.01071904 Pd 7.84522213 2.99169263 5.08517944 737.09179361 388.55931419 543.31404849 Pd 8.96081200 3.57467618 5.90775423 -734.05321093 -383.18565677 -542.03831669 Pd 6.60524941 0.50214143 7.52542859 -177.80991178 549.33705876 -544.28643749 Pd 8.53374952 1.17596760 8.98018331 0.58753658 0.27708818 0.38499379 Pd 4.89644542 2.42869982 7.26041789 165.93436609 -356.18508549 13.04426074 Pd 6.58114781 3.94022902 8.77392839 216.98233650 255.28665520 -194.66134900 Pd 0.27907522 5.41251581 4.54587726 397.24069084 -515.10540207 -147.19048276 Pd 0.96968342 6.21763330 6.46430809 -234.34893814 344.24596168 244.24295511 Pd 2.69585964 7.09208628 5.31014333 51.72361762 81.69338091 57.40845706 Pd 3.54752843 8.54549530 6.30647163 525.69905999 -605.22978265 620.30769913 Pd 2.41245106 5.13870796 7.86357929 -185.10763408 -362.99625156 196.88237498 Pd 4.17676540 6.26071901 8.86462790 4.00297988 -4.77637359 9.81860599 Pd 0.14770342 7.45139570 7.31689414 223.51797116 -348.70380550 -241.86112484 Pd 1.05120155 8.99814510 8.57776585 3.83632212 6.81761828 5.15194808 Pd 5.11767656 5.25306836 4.81443900 21.60860100 -283.13401875 135.44964850 Pd 6.00527271 6.28229395 6.21753981 -50.55106472 -59.68551934 -80.24703743 Pd 7.42148262 7.87324320 4.89234485 59.53044319 -54.02836200 -18.34948015 Pd 8.70021914 8.47084061 6.38563063 -20.84224570 -9.31025407 -23.54202127 Pd 7.56614708 5.09407382 7.89174020 -178.39745066 -239.63760880 220.67244131 Pd 9.15196235 5.77696272 8.95552113 -38.22862281 -16.92628327 -25.25506637 Pd 4.37572330 7.78424922 7.28341693 -576.27452578 532.35930841 -682.48824371 Pd 6.37926611 8.60581648 8.14429347 3.38521848 0.40578787 -0.21262453