864 Lattice="24.640153884887695 0.0 0.0 0.0 24.640153884887695 0.0 0.0 0.0 24.640153884887695" Properties=species:S:1:pos:R:3:forces:R:3 energy=-6377.330128575447 stress="-0.0022672002798540592 -4.8321562267171516e-05 4.666785593473356e-05 -4.8321562267171516e-05 -0.002256374851264468 1.7299312767727206e-05 4.666785593473356e-05 1.7299312767727206e-05 -0.0022069032834461746" pbc="F F F" Ta 0.00166860 0.01160439 0.00838499 0.75444040 0.77585139 0.79709277 Ta 2.06892043 2.03881361 0.01223150 0.16652412 0.28375884 0.17320291 Ta 2.05556826 0.01220016 2.07112939 0.15232857 0.11614776 0.04732280 Ta 0.01507276 2.04694536 2.04265642 0.27132400 0.33650885 0.23832219 Ta 4.08546914 0.03220970 0.01832181 -0.05274374 0.32903702 0.49484665 Ta 6.15839580 2.01416761 0.03912183 -0.11122416 0.36893697 -0.01392079 Ta 6.16774643 0.00158352 2.03582529 -0.09954071 0.05483715 0.25451888 Ta 4.06680346 2.08752347 2.07435458 0.09508896 -0.20572235 -0.34030935 Ta 8.19354191 0.03458261 0.00412083 0.04310276 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6.19873048 0.29614111 -0.11579594 -0.31053890 Ta 16.39073805 18.45511267 6.15963127 0.25805582 0.19029137 0.09434005 Ta 20.57119231 16.39009063 4.10081115 -0.04758886 0.32902176 0.01744681 Ta 22.61032550 18.44822892 4.13303727 -0.14406225 0.20868010 -0.16152974 Ta 22.58513589 16.41380677 6.19703813 0.03641367 0.06072884 -0.21218572 Ta 20.50795218 18.51559093 6.11970090 0.48843066 -0.09561629 0.35129139 Ta 0.04325754 20.49816776 4.12110158 -0.01537282 0.07646581 -0.14946131 Ta 2.02915627 22.57554141 4.06141151 0.22284803 0.01437686 0.11044959 Ta 2.03037302 20.59060868 6.18385934 0.13717462 -0.14083473 -0.23485076 Ta 0.01306229 22.57865533 6.19252300 0.38874726 -0.32235453 -0.22007109 Ta 4.10259163 20.53786434 4.14282077 -0.20799827 0.16044361 -0.32620058 Ta 6.18746953 22.60996385 4.10945942 -0.17863185 -0.07976122 -0.14785390 Ta 6.13370934 20.49633462 6.17167647 0.02196112 0.39421178 -0.15725558 Ta 4.11509060 22.60578913 6.12342960 -0.07902704 0.00228037 0.01750297 Ta 8.21705857 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22.61378172 20.52640181 6.17796019 -0.10613340 -0.08805718 -0.03215678 Ta 20.54671470 22.55970980 6.12209812 -0.16484639 -0.02345569 0.16903729 Ta 0.01437383 0.02074331 8.23129681 0.38437158 0.38466155 -0.04014214 Ta 2.06315838 2.08615305 8.20816112 -0.14066792 -0.24076300 0.07524575 Ta 2.01260567 0.03037694 10.24234125 0.29428999 0.05582593 0.11360032 Ta 0.00872024 2.08203969 10.23780104 -0.05442875 0.01190081 -0.03752757 Ta 4.11288748 0.02738658 8.19543659 -0.19273850 -0.16943055 0.24003613 Ta 6.13405030 1.98253195 8.21789485 0.12589784 0.27774387 -0.06693588 Ta 6.20661001 0.03132972 10.26578389 -0.09237357 -0.32432031 -0.03268527 Ta 4.11708510 2.04372845 10.30414190 -0.11397260 -0.16356775 -0.29090587 Ta 8.18249547 0.00879635 8.18478289 0.25347871 -0.00577216 0.00787753 Ta 10.30259259 2.07235814 8.18499978 -0.20521491 -0.41341652 0.21172340 Ta 10.28528203 0.01571584 10.28765269 -0.28080131 0.02677385 -0.23077306 Ta 8.17273809 2.07871255 10.25442055 0.43728727 -0.24504863 -0.04392605 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10.26852154 -0.25071542 0.18732021 -0.09802844 Ta 20.53786934 8.25195695 8.20792014 0.19000565 -0.30726938 -0.06987535 Ta 22.56860020 10.23655990 8.21749423 0.15978993 0.17457749 0.09287011 Ta 22.62535459 8.18041233 10.28441535 -0.05869381 0.20598540 -0.12263370 Ta 20.49641517 10.22919887 10.25426831 0.47387132 0.11610340 0.11477625 Ta 0.00207637 12.33746404 8.15660873 -0.12660855 -0.23485118 0.16898547 Ta 2.01508748 14.34337755 8.24345912 0.23337624 0.07387432 -0.13948050 Ta 2.04817908 12.35916727 10.30603684 -0.21992642 -0.43472272 -0.42407469 Ta 0.03311851 14.34201326 10.22787380 -0.25843233 0.25512135 0.20842359 Ta 4.13580261 12.31994317 8.19717330 -0.32267327 -0.02995211 0.13470930 Ta 6.13482752 14.33996829 8.17842596 0.09806822 0.30486685 0.13859606 Ta 6.14185166 12.27673540 10.29499099 0.01918117 0.13264257 -0.26912117 Ta 4.10751879 14.40211584 10.28505096 -0.02664228 -0.13319017 -0.20812343 Ta 8.24030646 12.29518132 8.21257626 -0.17989571 0.12287746 -0.13622582 Ta 10.29235824 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0.00750976 Ta 20.55646655 14.35537011 10.23497339 0.43085793 0.06295086 0.11068096 Ta 0.02404949 16.39664325 8.18408382 -0.17318337 0.15821287 0.05948793 Ta 2.03176699 18.47635343 8.23455983 -0.11042421 0.23891711 -0.23200412 Ta 2.07019325 16.45466347 10.22573612 -0.40338960 -0.22451542 0.31014293 Ta 0.04904547 18.48390649 10.28854858 -0.12794775 0.20290931 -0.08311573 Ta 4.09305709 16.43985676 8.23128340 -0.17736279 -0.14211538 -0.24519514 Ta 6.13252031 18.46903374 8.19224844 0.12560359 0.29743231 0.15982606 Ta 6.19405785 16.46724868 10.26258795 -0.10869416 -0.23184922 -0.09730399 Ta 4.11489276 18.46222697 10.29707206 -0.26991543 0.21755914 -0.17082555 Ta 8.24837274 16.45784148 8.17679353 -0.21100128 -0.19041650 0.07646723 Ta 10.26853894 18.47647295 8.21900816 -0.01403139 0.16709719 -0.16461759 Ta 10.29821980 16.46377164 10.24668116 -0.23980466 -0.20412517 0.13381600 Ta 8.23868465 18.47106327 10.27873181 -0.14654870 0.24665110 -0.10662221 Ta 12.28344574 16.43050403 8.20759881 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0.33691200 0.01007665 Ta 6.15084667 16.45712584 14.35636200 0.16677695 -0.21805571 0.18641874 Ta 4.11945137 18.44887623 14.35629434 -0.08933332 0.35832657 0.17280394 Ta 8.24181710 16.46601294 12.32483376 -0.18775775 -0.42788841 -0.04901405 Ta 10.28170397 18.46684397 12.34916993 -0.06387087 0.29117934 -0.24476207 Ta 10.29891096 16.45441488 14.32583324 -0.28612327 -0.26136129 0.25702032 Ta 8.21346475 18.52041308 14.33912422 -0.03825920 -0.08409446 0.33508464 Ta 12.32611374 16.44044599 12.28214632 0.02609328 -0.23582512 0.10705239 Ta 14.33919190 18.46144001 12.34854027 0.16784436 0.23016377 -0.10797299 Ta 14.35806685 16.45301109 14.40581063 0.14723768 -0.21545817 -0.15864761 Ta 12.30436703 18.45777474 14.35606828 0.11902512 0.31042345 0.19222058 Ta 16.44110215 16.45624782 12.28786913 -0.05428388 -0.35690556 0.21887155 Ta 18.49070811 18.44055948 12.28982657 0.18118455 0.41994175 0.06411432 Ta 18.45945499 16.40090539 14.34569975 0.24680607 0.20512396 0.09447376 Ta 16.46627805 18.49802384 14.33475644 -0.13849115 0.14123997 0.12671213 Ta 20.52003934 16.39018329 12.35371130 0.40620538 0.21778598 -0.32436313 Ta 22.61783766 18.45286735 12.37473769 -0.18128034 0.15130680 -0.09900610 Ta 22.58157361 16.42215009 14.33661260 0.06834737 0.08489615 0.23568164 Ta 20.53184892 18.51599432 14.38891413 0.09589070 -0.20914797 -0.24448260 Ta 0.03813262 20.56823436 12.31947564 0.02174182 -0.41794255 0.09776181 Ta 2.02654842 22.57357834 12.28117875 0.36125040 -0.04022095 0.19639531 Ta 2.08924460 20.52061504 14.39892045 -0.25014800 0.42187235 -0.15397258 Ta 0.01742366 22.57803275 14.34468584 0.50045449 -0.47545627 0.10965048 Ta 4.11960675 20.51208745 12.28247195 -0.12840205 0.50141177 0.34234482 Ta 6.18940236 22.58496872 12.34367084 -0.26970305 0.11273124 -0.21815967 Ta 6.17914698 20.54781051 14.36650320 -0.32578181 0.03662021 0.16445116 Ta 4.10476091 22.61056512 14.39091274 -0.17805340 -0.09314417 -0.19569962 Ta 8.17826181 20.53893243 12.32129339 0.26782925 0.22117101 -0.14430763 Ta 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