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=-0.004401677812221526 stress="0.37395791553813645 0.11798801892521588 0.30960313670050693 0.11798801892521588 1.227183099291567 -0.8480238609063698 0.30960313670050693 -0.8480238609063698 0.6318547849107765" pbc="F F F" He 0.11775054 -0.03975236 -0.05914226 0.25326515 0.33548128 -0.09921187 He 1.27696427 1.41661558 -0.03487808 -0.01794171 -1.00790849 0.64043750 He 1.72586561 0.29391194 1.22614529 -0.22061146 0.65440837 -0.64699338 He 0.00838575 1.20060506 1.68220204 -0.01471199 0.01801884 0.10576775