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=93.26486927159569 stress="-9.416052943741514 0.3472278824589318 0.5728845722154556 0.3472278824589318 -5.0441141005493835 0.008366305207918803 0.5728845722154556 0.008366305207918803 -7.777200810692119" pbc="T F T" Cs -0.01036258 0.01361598 -0.14801295 -41.44141911 -40.95880867 55.73373282 Cs 1.47567541 1.56329927 -0.06254558 25.82817298 39.91213726 45.88162320 Cs 1.27846858 0.09073906 1.77219963 48.46090717 -47.15510831 -60.40323597 Cs 0.13670048 1.63132919 1.75978669 -32.84766104 48.20177972 -41.21212006