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=30.158745926255808 stress="-2.7710013790469192 0.1648332716692178 0.8979683791857096 0.1648332716692178 -2.3461847517522396 0.5300952788749669 0.8979683791857096 0.5300952788749669 -3.4227823767194216" free_energy=30.158745926255808 pbc="F F T" Ni 0.29874826 0.05835534 -0.25354363 -28.37445794 -23.38569716 15.71776334 Ni 1.48193431 1.42001865 0.20070203 26.92285257 23.06676026 -14.67857812 Ni 1.20342959 0.28187239 1.51001192 39.25498247 -28.75474767 -6.42846816 Ni 0.10170120 1.37793365 1.21904386 -37.80337711 29.07368458 5.38928294