108 Lattice="11.854120698326488 0.0 0.0 0.0 11.854120698326488 0.0 0.0 0.0 11.854120698326488" Properties=species:S:1:pos:R:3:forces:R:3 energy=-729.0537183871817 stress="-2.6929118855824283 0.1754376481307336 -0.49817011081847795 0.1754376481307336 -4.261724202730925 -1.1089902337049438 -0.49817011081847795 -1.1089902337049438 -3.6863328322446485" pbc="F F F" Ta 0.02724678 -0.02632588 -0.03557682 1.76863392 1.79588547 1.86239191 Ta 1.96012906 1.98166413 0.02449507 -0.20277192 -0.83629911 -0.90085625 Ta 1.92799073 -0.02053335 1.97407151 0.01074987 -0.52161130 -0.35229850 Ta -0.01760663 1.96885734 1.96044793 -0.91025067 -0.68933457 -0.48863450 Ta 3.96641957 0.02966971 0.03916344 -0.48302869 0.49285698 0.48155278 Ta 5.91738927 1.93142497 0.00280429 0.31508001 0.13919842 -0.68826000 Ta 5.89310089 -0.00580975 1.95591212 0.37839595 -0.83245665 0.00577076 Ta 3.96083018 2.00976130 2.01204902 -0.26837799 -0.78263395 -0.42587450 Ta 7.89819024 -0.01422034 0.03192214 -0.00004310 0.99914213 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