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=2.2259901882690896 stress="-75.03966393591347 5.86241708270929 31.90618604361945 5.86241708270929 -69.47762344614007 17.015919149339812 31.90618604361945 17.015919149339812 -70.8747076584315" pbc="F F F" Ru -0.01546661 0.10170120 -0.12206635 -12.62154156 -14.63014782 -8.08757069 Ru 1.21904386 1.50082602 0.24624097 35.66476609 38.29664458 -45.54906247 Ru 1.55636285 0.00987676 1.31288604 26.87256342 -35.50139784 9.10221688 Ru 0.20947124 1.16938580 1.55280714 -49.91578796 11.83490109 44.53441628