256 Lattice="16.01524947203886 0.0 0.0 0.0 16.01524947203886 0.0 0.0 0.0 16.01524947203886" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1796.9981751688142 stress="-0.007474235026518931 -0.0004403607413223229 -0.00023847014747411117 -0.0004403607413223229 -0.00755781761329927 0.00014110148223076425 -0.00023847014747411117 0.00014110148223076425 -0.00800891274470555" free_energy=-1796.9981751688142 pbc="F F F" Ta 0.02862827 0.02300282 0.01862981 1.80807577 1.78337470 1.57148389 Ta 2.01589566 1.99515965 0.02316223 -0.60532280 -0.30282109 -0.73428457 Ta 2.01895767 0.00533380 1.94960291 -0.77240493 -0.38260166 0.03978920 Ta 0.03567743 2.03589228 1.97557372 -0.40340327 -0.66420717 -0.21868624 Ta 4.00280096 0.01994977 0.03587066 -0.01169681 0.56800648 0.51165478 Ta 6.00059545 2.01548886 0.00495783 0.12496068 -0.25483251 -0.45358618 Ta 6.05320475 0.03373970 1.97340756 -0.13984815 -0.61819664 -0.25682991 Ta 4.01587127 1.96190991 1.94271408 -0.29247722 0.10721647 0.41806142 Ta 7.99621372 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