108 Lattice="11.738278239054992 0.0 0.0 0.0 11.738278239054992 0.0 0.0 0.0 11.738278239054992" Properties=species:S:1:pos:R:3:forces:R:3 energy=-727.6220732096764 stress="-4.498755769460186 1.7591800467045826 0.24367123494861076 1.7591800467045826 -3.8692065646353413 1.350176081533971 0.24367123494861076 1.350176081533971 -4.6193703339739685" pbc="F F F" Ta 0.03693360 -0.01433811 -0.00698548 0.78977637 0.77263474 0.84099245 Ta 1.96904245 1.94335246 -0.01004799 0.32802689 0.47451467 -0.16264601 Ta 1.94202785 -0.02107228 1.99520095 0.27631402 -0.23646536 -0.01452521 Ta 0.02191377 1.96847275 1.95985352 -0.40161825 0.30708996 0.19797159 Ta 3.88780159 0.00857760 0.00618800 -0.20058869 -0.00214257 0.30915063 Ta 5.84721004 1.92807357 0.03042421 0.34622386 0.42501433 -0.68542948 Ta 5.89346358 0.00367649 1.94218756 -0.01410558 -0.56162758 0.34186769 Ta 3.90342357 1.92435763 1.94427379 -0.30485844 -0.38108777 -0.46040242 Ta 7.84584633 -0.00813556 -0.00143401 -0.68801836 0.49572647 0.44996799 Ta 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