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=570465.1822159317 stress="-1714572.9987740284 -983524.110195539 -1668131.0116003817 -983524.110195539 -2111111.6940305606 -12104.520235111937 -1668131.0116003817 -12104.520235111937 -3045337.223055525" pbc="F F F" Md -0.19454049 0.32291894 0.92007598 -3039.02713666 -1851.24531685 109.25761548 Md 1.44783958 1.29854643 0.84514147 -49342.35859062 -176642.59161050 96716.22877463 Md 1.79308698 2.48927083 0.19731307 51852.44387997 178856.53856301 -97324.12352749 Md 4.21977371 3.69835490 0.80029490 -34158.75230787 -695647.53893577 440354.40817098 Md 2.90817607 0.14128186 1.87988452 275.00072785 -724.83550413 10.90683759 Md 4.04682625 1.18663917 3.43712529 -735.26653507 -7173.58238870 1861.26620647 Md -0.17233095 2.48028318 2.37064422 -81.72184741 73.99908457 77.19034517 Md 1.99338333 3.55731446 3.60599615 -798.62646407 -279.63685535 -140.40563817 Md 5.34884113 -0.22883018 0.24401199 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