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=16.091149061618452 stress="-3.2394899067054617 0.8800005442782094 -0.288503392889789 0.8800005442782094 -2.8045687458986244 -0.08708538094292192 -0.288503392889789 -0.08708538094292192 -3.2697826989740744" pbc="T T T" Ni 0.01283276 -0.06713695 -0.17141964 25.24163693 19.01369186 16.31463192 Ni 1.64720807 1.58942344 -0.04293576 -22.55513086 -26.82161128 8.25866106 Ni 1.77559981 -0.28678287 1.71736445 -54.47390523 54.06984860 -19.63120532 Ni -0.21395222 1.70384132 1.29224623 51.78739917 -46.26192918 -4.94208766