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=-1.3015878156564915 stress="2.4288789955141246 0.059484378819376 -0.0224244021627118 0.059484378819376 2.0336761381240405 0.02297018618133495 -0.0224244021627118 0.02297018618133495 2.5018144922695305" pbc="F F F" He 0.04852473 0.05473499 -0.08438932 0.86214348 0.72158548 1.00510063 He 1.63661615 1.40480033 -0.12280496 -0.67868584 -0.86284168 0.65670021 He 1.29869006 0.11041876 1.26735611 -0.94999138 0.91631966 -0.93945406 He -0.16466555 1.24148635 1.58611608 0.76653374 -0.77506347 -0.72234679