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=6.249076996407401 stress="-2.041863670060577 -0.12363855584531577 0.5489789730399338 -0.12363855584531577 -3.5630350406047424 0.1849428056537644 0.5489789730399338 0.1849428056537644 -3.191832470025776" free_energy=6.249076996407401 pbc="F T T" Cu 0.22094491 0.23171545 0.18190327 -19.59381803 -3.56387119 -6.21278975 Cu 1.32183498 1.71219253 -0.07514625 20.89936506 -7.60633813 3.37097743 Cu 1.62990665 -0.21779550 1.78278197 20.35648733 8.60202625 -11.53337395 Cu 0.06210000 1.63362859 1.32702941 -21.66203437 2.56818307 14.37518627