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=105.38807506451901 stress="-14.26696922401755 1.4082212171574742 -0.8203307136297056 1.4082212171574742 -14.504561595540407 -0.13114940585948623 -0.8203307136297056 -0.13114940585948623 -8.131088026148182" pbc="T T F" Zr 0.12863053 -0.08303344 0.15488783 -30.91162395 -35.67809814 -91.98401043 Zr 1.55988540 1.20245745 0.16431082 18.14572989 29.51367337 -71.77953816 Zr 1.14522227 -0.01155935 1.53277713 73.87911174 -66.68988669 88.10536832 Zr 0.12558536 1.09980665 1.46097674 -61.11321769 72.85431145 75.65818027