108 Lattice="12.331141846163518 0.0 0.0 0.0 12.331141846163518 0.0 0.0 0.0 12.331141846163518" Properties=species:S:1:pos:R:3:forces:R:3 energy=-752.793528141071 stress="-0.01336919878131573 -0.00020676615845828118 0.0003996409401787442 -0.00020676615845828118 -0.013201940278540457 0.0004847695848737904 0.0003996409401787442 0.0004847695848737904 -0.01301666747398208" pbc="F F F" Ta 0.03332865 0.02441736 0.02573365 0.77423924 0.84781991 0.78967359 Ta 2.08462475 2.03528630 0.03042867 -0.81105160 -0.21080790 -0.68072407 Ta 2.04655182 0.00976779 2.06045223 -0.28055645 -0.61730083 -0.48709511 Ta 0.04002726 2.08019677 2.03719478 -0.69155507 -0.70368336 -0.33551537 Ta 4.07783743 0.04059885 0.03789803 0.48596281 0.17040196 0.26005863 Ta 6.18522158 2.08818959 0.02216928 -0.25844134 -0.61214819 -0.47323663 Ta 6.20431360 0.04022253 2.05287519 -0.33287019 -0.63480712 -0.37590770 Ta 4.09706847 2.07072352 2.08875614 0.21596735 -0.59901693 -0.63074023 Ta 8.18651891 0.00572278 0.00318582 0.75548051 0.63712288 0.57805613 Ta 10.24521801 2.05769974 0.00292362 -0.61288153 -0.43206615 0.66755537 Ta 10.30488779 0.01223848 2.02846565 -0.96384879 0.84264158 -0.22766490 Ta 8.22826822 2.02655998 2.08414986 0.89951792 -0.31675094 -0.69471362 Ta 0.00525389 4.12298362 0.02092146 0.28913661 -0.12831144 0.24684122 Ta 2.04047973 6.12675719 0.02380025 -0.33206658 0.26754795 -0.45864179 Ta 2.04611728 4.08315180 2.08241166 -0.31888651 0.34106480 -0.35206376 Ta 0.01007794 6.12363581 2.09055087 -0.31184441 0.30260544 -0.49610302 Ta 4.08043937 4.13174267 0.02472049 0.22385292 -0.23468063 -0.61664115 Ta 6.19399555 6.12852360 0.03225434 -0.33163349 0.24636005 -0.74006409 Ta 6.14708890 4.08216887 2.05685299 0.16901808 0.11682724 -0.21900790 Ta 4.11051562 6.13717701 2.05751719 0.06765379 0.15924686 -0.17783759 Ta 8.21311815 4.12512011 0.03882540 0.63932902 -0.30999698 -0.63205411 Ta 10.28534515 6.12601904 0.01645816 -0.36145964 0.33594485 0.23474972 Ta 10.29025364 4.13383717 2.04680924 0.38516285 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0.28310635 0.22174498 Ta 2.07352318 2.02864284 4.12049856 -0.27751062 -0.20615326 0.15124816 Ta 2.04986392 0.01766028 6.16930253 -0.15920823 -0.57704165 -0.28082940 Ta 0.02674428 2.04745603 6.13902229 -0.61908175 -0.27766363 0.01853993 Ta 4.15092872 0.00652214 4.08745486 -0.12475184 -0.38632970 0.23447392 Ta 6.18755791 2.05186953 4.10349669 -0.00233400 -0.33399710 0.21432495 Ta 6.15214832 0.02259766 6.18465081 0.17818588 -0.55372869 -0.06471718 Ta 4.16614839 2.06875275 6.20425138 -0.39984454 -0.56632550 -0.51213968 Ta 8.24155839 0.02991566 4.14049450 0.45649754 -0.41179709 -0.17523837 Ta 10.29950499 2.07719874 4.11199510 0.15500884 -0.60815399 -0.18068338 Ta 10.26790536 0.02346618 6.13253570 -0.35736504 0.51922175 0.34424765 Ta 8.20376567 2.09034266 6.20416691 0.76681099 -0.57306672 -0.27099234 Ta 0.03076214 4.11681248 4.12636593 -0.41644483 0.00538051 0.19031226 Ta 2.08410601 6.19798508 4.16503955 -0.58813788 -0.37490416 -0.35237063 Ta 2.08644449 4.09284348 6.19226502 -0.55982963 0.15516851 -0.27387272 Ta 0.00042817 6.17213983 6.19404143 -0.35728636 0.05570926 -0.23850302 Ta 4.13480423 4.07840513 4.09205538 -0.21581331 0.22758562 0.23134013 Ta 6.19190380 6.14740208 4.10234246 -0.18064639 0.21288988 0.17511689 Ta 6.13484742 4.09604318 6.17368654 0.28050512 0.28336068 -0.24887076 Ta 4.07770724 6.12925454 6.13655893 0.39204165 0.49714824 0.35636050 Ta 8.22916269 4.13133469 4.09408234 0.37229730 -0.20173756 0.19780997 Ta 10.27741272 6.12496853 4.07124452 0.18560286 0.43944708 0.37166806 Ta 10.29655368 4.08981301 6.14252982 0.21626037 0.30170560 0.11748356 Ta 8.20515273 6.15120245 6.20081696 0.62406755 0.18107347 -0.45181505 Ta 0.00372215 8.20317047 4.10293493 -0.30302551 0.59764890 -0.08999525 Ta 2.06795073 10.29748349 4.14367812 -0.30143583 0.13856335 -0.44558122 Ta 2.02610346 8.27854098 6.11398709 0.13740147 -0.14196673 0.25931531 Ta 0.04192727 10.26736690 6.16048379 -0.12890968 0.02685601 -0.37529057 Ta 4.13625835 8.20120563 4.10305231 0.08202987 0.55824405 0.20811587 Ta 6.12601547 10.29162419 4.08596417 0.19789622 0.28482467 0.28948502 Ta 6.19209545 8.26141200 6.20622490 -0.38160427 -0.10392118 -0.38074962 Ta 4.14831627 10.29317228 6.20460811 -0.24726824 0.25392097 -0.39465803 Ta 8.18695463 8.23521871 4.09780457 0.77036556 0.12669815 0.22078814 Ta 10.27206334 10.26400276 4.11658024 -0.39773865 -0.52439208 -0.10926349 Ta 10.25494940 8.23514490 6.15942283 0.21194578 0.02000971 -0.15799511 Ta 8.22903312 10.27426371 6.14717973 0.35770893 0.39422682 0.09620038 Ta 0.03356034 0.03947958 8.19948154 0.30084774 0.45789364 0.63342437 Ta 2.05005796 2.06552833 8.18402498 -0.53922655 -0.43568016 1.08309798 Ta 2.01429531 0.00378078 10.28960392 -0.04165668 0.60405048 -0.72459216 Ta 0.03777528 2.05656329 10.30674078 0.50549283 -0.20450913 -0.85037314 Ta 4.07135080 0.03348206 8.20242097 0.19096670 -0.54793496 0.76026656 Ta 6.17852896 2.08679315 8.22346974 -0.15132050 -0.63523926 0.63378232 Ta 6.19551165 0.03300619 10.25256706 -0.45866579 0.14576367 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0.53053951 Ta 10.25843851 6.15327343 8.22802946 0.39006337 0.20605971 0.28842730 Ta 10.24790770 4.10288825 10.23825074 -0.42663594 -0.08476897 -0.34384122 Ta 8.21975809 6.19797286 10.27547452 0.30053804 -0.25628643 0.43845864 Ta 0.02368267 8.29819949 8.18843845 -0.53724442 -0.17695106 0.79602026 Ta 2.04245336 10.23832201 8.18541359 -0.14769937 0.80026619 0.90051413 Ta 2.09501004 8.25939793 10.29071643 -0.65112970 0.21070797 0.23982017 Ta 0.03870234 10.25913661 10.24727044 0.85929680 -0.71343567 -0.70112246 Ta 4.07636474 8.20620832 8.24412302 0.28966660 0.11166759 0.19099382 Ta 6.12681102 10.26513348 8.23189940 0.71031664 0.44438602 0.64726656 Ta 6.15016074 8.21165166 10.28941898 0.16933028 0.51895297 0.16183195 Ta 4.16213526 10.28443486 10.23601174 -0.34529877 -0.32849995 -0.11515070 Ta 8.20479672 8.23448666 8.23286598 0.75374709 0.80988466 0.82150035 Ta 10.29527974 10.23589866 8.19161670 -0.93993436 -0.56744181 0.83359202 Ta 10.26205935 8.19965862 10.29794799 -0.76900669 0.77851229 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