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=9.071418885755849 stress="-2.6161101305090875 0.11505642522195433 -0.027849882237042125 0.11505642522195433 -2.2629086450671583 0.5162342019909452 -0.027849882237042125 0.5162342019909452 -2.1554483894118053" pbc="T F F" Ni 0.08343331 0.22094491 0.23171545 -15.42128262 -16.92024880 -21.29974511 Ni 1.50893269 1.32183498 0.21219253 11.03146865 34.55671437 -28.45270032 Ni 1.42485375 0.12990665 1.28220450 14.75944507 -32.61335182 34.45119605 Ni 0.28278197 1.56210000 1.63362859 -10.36963111 14.97688624 15.30124938