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=-15.59351173296896 stress="-0.2874464083477707 -0.07482864284732595 0.04584620839078384 -0.07482864284732595 -0.27077719586057836 -0.027884383569622594 0.04584620839078384 -0.027884383569622594 -0.11032431879843761" free_energy=-15.59351173296896 pbc="F F T" Ni 0.04376171 0.19273990 -0.19277068 -2.79098914 -4.00002370 1.64331687 Ni 1.26172667 1.55332204 -0.11563527 5.18050241 3.09649465 1.84961632 Ni 1.73110688 0.01283276 1.70071341 1.07239745 -1.16454122 -1.97568445 Ni 0.14720807 1.58942344 1.45706424 -3.46191072 2.06807027 -1.51724873