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=65.18951434661146 stress="-7.192154198476349 0.3019617703107554 0.032431801884301795 0.3019617703107554 -5.130231356887732 -0.03705506841399748 0.032431801884301795 -0.03705506841399748 -4.948292086541061" free_energy=65.18951434661146 pbc="T F F" Cd 2.85198705 0.06329927 0.09073906 28.21023394 -61.66301700 -46.75836354 Cd 1.77219963 1.43381326 0.13132919 -33.85841485 53.20505283 -44.47883277 Cd 1.75978669 0.18365717 1.70288723 -28.13240309 -49.60730030 45.40157694 Cd 0.08343331 1.29585403 1.44809454 33.78058400 58.06526448 45.83561937