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=-4.8640823580904575 stress="-0.5562855069311645 -0.0016299713791317523 -0.07574738974763624 -0.0016299713791317523 -0.4721274397708679 0.08897651803469318 -0.07574738974763624 0.08897651803469318 -0.5163582900259058" pbc="F F T" Ni 0.21211731 0.29594673 0.21042663 -5.28511698 -6.47129753 -1.66369384 Ni 1.49042854 1.35687199 0.20775101 5.51961442 6.53369566 -1.98552244 Ni 1.74122900 0.02201293 1.31634348 4.66839311 -4.90059064 3.06200960 Ni 0.04376171 1.22051529 1.69273990 -4.90289055 4.83819251 0.58720668