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:Z:I:1:forces:R:3 energy=150.267232163 pbc="F T F" Ba 0.21711796 -0.05388404 0.06469383 56 -43.75305606 -13.73196942 -41.09455718 Ba 1.37241235 1.08946913 0.10459395 56 46.02897909 15.68883809 -49.46954290 Ba 1.22286420 0.16444634 1.25205420 56 38.07529193 -24.20245101 48.19410332 Ba 0.44879977 1.28603070 1.20245745 56 -40.35121496 22.24558234 42.36999675