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=8.48689061677 stress="-7.027380557131994 -0.07863933482776593 -0.00346235370411771 -0.07863933482776593 -10.889475271207282 -0.4645426352833706 -0.00346235370411771 -0.4645426352833706 -8.200570515143683" pbc="F F F" Ta 0.02103145 -0.22238644 0.18220204 -12.25804255 -11.84710345 -14.39399016 Ta 1.39362841 1.73573857 0.02724172 9.60280085 10.59356501 -10.93713819 Ta 1.27538150 -0.29703668 1.34887301 14.17750895 -13.72190198 9.44973783 Ta 0.22083292 1.28984966 1.48735431 -11.52226725 14.97544041 15.88139052