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=10.767535176211538 stress="-756.1110481940207 -150.24134611455747 -186.81279425862363 -150.24134611455747 -897.1707350929978 -175.61237944325785 -186.81279425862363 -175.61237944325785 -695.67773961072" pbc="F F F" Ta -0.00393080 -0.02264065 0.17095038 -5.56588173 -2.60747369 -4.54602880 Ta 1.46562791 0.84696809 1.40199409 -6.82821812 21.92260658 -10.16768490 Ta 2.16068129 2.85760404 0.07467016 -10.14451512 -7.63820815 -6.98178615 Ta 3.50439459 4.05820902 0.96963622 6.26455989 6.38688268 9.16734695 Ta 2.30539633 -0.39679315 2.44151616 12.89629960 -20.03624402 17.41639590 Ta 3.21919360 1.57348889 3.98978639 -1.14851284 0.99084342 -0.52989184 Ta -0.07989989 2.70988817 2.23334514 -22.63379466 -16.70964077 -18.73387021 Ta 1.08168652 3.61354409 3.25203356 17.28527079 8.16532473 17.74601556 Ta 5.78586493 -0.34232212 -0.01949703 1.45500149 1.78803581 1.45801959 Ta 6.51531700 1.78301916 1.16407746 5.47537755 -11.45004238 -4.57947153 Ta 7.63783312 2.59720718 -0.49878402 -6.23313297 -8.68814115 -18.01858307 Ta 8.61030713 3.73086833 0.74590164 9.12872464 10.37386518 11.41874695 Ta 8.29327876 -0.21672952 2.72010757 -6.77127437 -26.53367736 -4.08212976 Ta 8.65703215 1.57058173 2.93125635 6.39086084 27.64312133 -0.39517072 Ta 5.32529069 2.75050972 2.41515836 -10.25639607 7.20127886 9.60145948 Ta 7.00538144 4.04863537 3.76667199 -2.49350825 -22.77564842 17.77756726 Ta -0.03269472 4.68518310 0.12973185 -6.80739072 -6.82561944 -3.21989166 Ta 1.45165187 5.91626987 0.93228237 -3.07350055 14.02540846 -25.94627450 Ta 2.49497655 7.78966064 -0.15981570 -5.87323573 -4.82344055 -9.00746925 Ta 3.65139370 8.72068896 1.23180489 5.44120223 5.27059269 8.37360283 Ta 1.97207921 5.44616489 2.59411349 5.47855153 -3.98594713 21.50594118 Ta 3.51849243 6.15515646 3.80750394 5.82014533 3.52473769 4.79550615 Ta 0.21202318 7.26101222 3.16863729 -15.56280572 -27.83349083 -8.26958163 Ta 1.01437609 8.80690368 3.63673171 11.79475576 30.78299939 2.57206850 Ta 5.35254479 4.93098350 -0.01555321 4.92183229 0.63334275 -2.25117308 Ta 6.11425537 6.24880483 2.06124325 6.55155362 -25.44843548 -21.32846752 Ta 6.67618364 7.81051301 0.24014761 -8.34348646 -3.65109566 -6.35352355 Ta 8.25916562 8.75197405 1.16076442 6.85554471 3.07663505 7.20018649 Ta 7.77109014 5.20101467 2.56754574 13.31849773 -14.28454700 -45.91476329 Ta 8.30695144 6.32594275 3.80136000 52.41609971 -6.64401285 0.59661502 Ta 5.23515741 7.56399505 2.78971197 -40.98175050 -20.66918193 -6.03660273 Ta 5.80409304 8.94919299 3.40264499 20.90511933 54.77177938 22.78277903 Ta -0.17947958 0.60094168 4.45789731 3.37497648 2.57070655 -0.82234959 Ta 1.34432264 0.88213332 6.70906900 -5.29019798 6.03105764 -5.57152519 Ta 1.94237812 3.36245105 5.41755521 -4.35788747 -1.84054701 4.27934224 Ta 4.03941735 4.31671840 5.77384052 -41.30999260 -7.88082359 49.98367986 Ta 2.74647813 -0.44008634 7.48810937 7.51451401 -6.89131190 3.42002147 Ta 4.33651355 1.45991070 8.36367604 -37.13660686 -33.77689551 28.50293837 Ta -0.07993774 2.50113346 7.87054360 -8.04493645 -4.07881921 -7.77413068 Ta 1.21545013 3.51703569 9.07894161 8.09363894 4.99862065 5.90519457 Ta 4.44381859 -0.16462014 5.37428025 0.10936178 0.55440709 1.43468900 Ta 6.71366766 0.89764578 6.54368674 -48.55741741 57.07525352 -66.94521073 Ta 7.66269000 1.81183571 5.12551085 8.37036297 10.01424136 -13.31860486 Ta 8.54482210 3.94533077 6.71134477 64.18668048 -101.94703701 -25.19151936 Ta 7.23058202 -0.00599211 7.52752358 27.98523489 -85.04685476 70.10862871 Ta 8.49859303 1.21763961 8.36643570 13.12109514 13.53367194 9.11398709 Ta 5.37008905 2.43014750 7.52698724 28.53932983 14.81991124 -47.14134176 Ta 5.55208164 3.81317802 8.70032774 6.99402771 23.37047117 19.17454389 Ta -0.31713080 5.02365876 4.90919424 1.15993499 0.86022599 1.02071666 Ta 1.63826415 6.42728387 6.74566835 -21.56061816 15.48606267 -16.56068840 Ta 2.14269776 7.62884593 5.13629877 -28.14225558 -14.34340380 -24.51021301 Ta 3.42536678 8.38986266 5.99044499 33.72317564 20.60491120 21.24699514 Ta 2.53804037 5.28717801 7.71099147 -2.56890027 -29.14709183 -0.18503016 Ta 3.82186071 5.45142080 8.97185425 19.47103355 0.66871951 25.46256354 Ta 0.01239893 7.35088479 8.08245432 -47.50610178 -49.89265310 -21.05930504 Ta 0.96275080 8.48049788 8.59991396 44.80434118 51.43249508 22.93785817 Ta 5.11785586 4.52035129 4.62082394 39.17524055 8.64358880 -43.66021869 Ta 5.78133253 6.61157439 6.54537996 5.29725798 -6.03663143 -10.65633249 Ta 7.26412584 7.28774688 4.60924636 -35.77894703 34.62140025 29.97340009 Ta 8.80859921 8.37873761 6.28796723 -1.02144457 -2.23754220 1.54944191 Ta 7.80678639 5.10182066 7.00053342 -66.33641206 99.48545718 22.41973070 Ta 8.88711081 6.40986479 8.58744355 -0.14537604 2.96916048 0.59052579 Ta 4.74111067 7.45735814 8.13687324 -148.69760779 -95.49033807 -86.98345570 Ta 5.62856250 8.10201287 8.73253648 144.85250270 104.91697992 97.20578174