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=1587.721413740256 stress="-200.14724457215902 58.043740410401774 -46.93738065479288 58.043740410401774 -265.71889021424863 -84.80779669017869 -46.93738065479288 -84.80779669017869 -246.11251278174703" pbc="F T F" Kr 0.11041876 -0.03194186 0.08611608 -2416.70853438 -282.18067917 -3069.17735242 Kr 1.53369179 1.52598936 0.29874826 1501.87360014 -1680.11160222 -2414.02240258 Kr 1.27290972 -0.11909813 1.36136659 2728.59653594 762.61730869 4107.34711030 Kr 0.05835534 1.24645637 1.48193431 -1813.76160169 1199.67497270 1375.85264469