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=96265.2249296469 pbc="T F T" Hf 0.19142744 0.01857539 -0.11472055 72 -224286.53820877 -84960.25243259 198705.03690309 Hf 1.38081475 1.57185536 -0.00324513 72 92499.37357862 87037.67776499 -23887.79030470 Hf 1.32203087 0.28527241 1.78750741 72 282442.22893007 -91125.60818868 -223958.05452063 Hf 0.19854542 1.47306373 1.24712868 72 -150655.06429992 89048.18285629 49140.80792224