4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=2.743218490287468 stress="-59.82480891316044 -5.0405624409475935 10.50332491315691 -5.0405624409475935 -56.58174873997781 -3.326441221343206 10.50332491315691 -3.326441221343206 -55.0973265984416" pbc="F F F" Zr -0.16903503 -0.11798803 -0.06699407 -16.19019794 -27.53642630 -10.58157345 Zr 1.22002482 1.27696427 -0.08338442 28.00649676 19.97904290 -24.19379515 Zr 1.46512192 0.22586561 1.79391194 11.31902975 -12.60474755 15.38171763 Zr -0.27385471 1.52103145 1.27761356 -23.13532857 20.16213095 19.39365097