256 Lattice="16.24632191587807 0.0 0.0 0.0 16.24632191587807 0.0 0.0 0.0 16.24632191587807" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1816.6047147614788 stress="-0.0036196062802387476 2.6997985061425153e-05 0.000702369579067623 2.6997985061425153e-05 -0.003542953965935298 8.280729498490905e-05 0.000702369579067623 8.280729498490905e-05 -0.003755099725419021" free_energy=-1816.6047147614788 pbc="F F F" Ta 0.00389672 0.01135499 0.02135395 0.68093077 0.67268357 0.62216365 Ta 2.04410872 2.06790750 0.02776036 0.10363157 -0.15489284 -0.08744954 Ta 2.08500142 0.00386093 2.00381974 -0.04815631 0.08784668 0.39497202 Ta 0.00487738 2.03178901 2.01907700 0.02706873 0.14901911 0.34980867 Ta 4.09674662 0.03072057 0.02601500 -0.20993264 0.34303610 0.11483415 Ta 6.07604210 2.03734863 0.02896813 0.16464022 0.13823825 -0.28749175 Ta 6.08353151 0.00694715 2.00578123 0.05069708 -0.18571483 0.38537904 Ta 4.09740135 2.03668290 2.06337894 -0.34045956 -0.39521050 -0.28503139 Ta 8.15232606 0.00255341 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