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=36.32215239854769 stress="-6.6973204580421815 0.6659518275767751 2.836390248359921 0.6659518275767751 -4.7768823684730455 1.785229037447807 2.836390248359921 1.785229037447807 -7.674084621916408" pbc="F F T" Ru 0.29874826 0.05835534 -0.25354363 -68.43557968 -40.94873559 56.54479965 Ru 1.48193431 1.42001865 0.20070203 60.08002890 45.98574638 -43.00338027 Ru 1.20342959 0.28187239 1.51001192 101.10317486 -66.60708952 -25.75029796 Ru 0.10170120 1.37793365 1.21904386 -92.74762408 61.57007874 12.20887858