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=-3.4945938979238758 stress="-10.530913010480287 -2.8262119927538647 -3.9369491126608205 -2.8262119927538647 -9.549585006659102 1.7057860587293572 -3.9369491126608205 1.7057860587293572 -12.068458534021342" pbc="F F F" Ni 0.27219963 -0.06618674 0.13132919 -5.90756653 -4.93493105 -3.88909854 Ni 1.75978669 1.22592512 -0.21495266 2.49979648 5.11664600 -3.51844241 Ni 1.68365717 0.20288723 1.58343331 4.46843434 -2.58067350 6.72712520 Ni -0.20414597 1.44809454 1.72094491 -1.06066428 2.39895856 0.68041576