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=-2.234810402987023 stress="-0.591767086261834 0.04467928469869054 0.00509764688484724 0.04467928469869054 -0.726214907823082 -0.006320116255333428 0.00509764688484724 -0.006320116255333428 -0.6731812443704704" free_energy=-2.234810402987023 pbc="T F F" Cr -0.14801295 0.06329927 0.09073906 4.73343443 -8.80063652 -6.39323722 Cr 1.77219963 1.43381326 0.13132919 -5.71719703 7.60060919 -6.01626322 Cr 1.75978669 0.18365717 1.70288723 -4.87019576 -6.93399129 6.18539132 Cr 0.08343331 1.29585403 1.44809454 5.85395836 8.13401862 6.22410912