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=30575.593707652315 pbc="F F T" Hf 0.21866194 -0.01993262 0.08150566 72 -76291.51082755 -13233.30140967 -49506.66093457 Hf 1.67488524 1.43993920 0.00585379 72 35390.51382031 9534.70077818 -19393.03157606 Hf 1.24736983 -0.15612284 1.50380232 72 72177.32290738 -22722.19338877 42190.54871707 Hf 0.21646286 1.62296227 1.20214762 72 -31276.32590015 26420.79402026 26709.14379356