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=2.750349589884621 stress="-66.23245394662663 -10.846688982517195 -7.139628796072074 -10.846688982517195 -49.94853464132442 4.4434136998161335 -7.139628796072074 4.4434136998161335 -68.09564283501024" pbc="F F F" Zr 0.27219963 -0.06618674 0.13132919 -28.95303271 -25.77124284 -19.40093312 Zr 1.75978669 1.22592512 -0.21495266 18.43746849 24.38893941 -21.44577489 Zr 1.68365717 0.20288723 1.58343331 23.20907100 -13.12399963 30.98799574 Zr -0.20414597 1.44809454 1.72094491 -12.69350678 14.50630306 9.85871227