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=14.279146985027516 stress="0.5515959841171039 0.2077135286755554 0.8576919991111406 0.2077135286755554 -0.7240078675155903 -0.5193298222769818 0.8576919991111406 -0.5193298222769818 -0.881174719061874" free_energy=14.279146985027516 pbc="T F T" N 2.70296332 0.22083292 2.78984966 -23.75308970 5.99240357 -13.73002650 N 1.48735431 1.38731147 2.90698366 6.76927933 -2.10848329 -11.04431656 N 1.68107110 0.13102478 1.64391750 25.65865296 -19.56840659 3.67974268 N 0.26120756 1.51193751 1.75226748 -8.67484259 15.68448631 21.09460038