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=39.20079541937829 stress="-4.402846516961269 0.08548186665384863 -0.10362970565332548 0.08548186665384863 -7.00506613416937 -0.33487975433535316 -0.10362970565332548 -0.33487975433535316 -4.530089561427883" pbc="F T F" Zr 0.18543805 -0.04539058 0.07327937 -33.30653028 7.43603017 -54.05110714 Zr 1.69989723 1.62961200 0.15720406 53.14049947 -9.99139016 -31.62134192 Zr 1.26564846 -0.11492400 1.79768454 34.81089978 11.74759028 47.43819654 Zr 0.17089611 1.47011124 1.20220318 -54.64486897 -9.19223028 38.23425251