256 Lattice="14.541804633591658 0.0 0.0 0.0 14.541804633591658 0.0 0.0 0.0 14.541804633591658" Properties=species:S:1:pos:R:3:forces:R:3 energy=-708.1751962002689 stress="-3.739779535022919 -0.05141726933132418 -0.32171123768347876 -0.05141726933132418 -3.824852262780695 0.9564498013341165 -0.32171123768347876 0.9564498013341165 -2.6836464529507076" pbc="F F F" Ni -0.03418767 0.02255172 0.01436710 -0.15197147 -0.31473944 -0.22829310 Ni 1.79438882 1.83825536 -0.03264345 0.73790277 0.10452689 -0.49501075 Ni 1.82300373 -0.00620710 1.85062802 0.40658165 -0.68304222 0.01999294 Ni -0.01695372 1.80112038 1.83049523 -0.60411234 0.64824843 0.47598904 Ni 3.63831078 -0.00600404 0.03404414 0.01322421 -0.37874944 -0.61728526 Ni 5.50023569 1.82848233 -0.00648720 -0.35486433 0.46991546 -0.77026132 Ni 5.45556893 0.01384760 1.82505205 -0.02403963 -0.87300182 0.38093847 Ni 3.64280195 1.78569972 1.80563152 -0.09300545 1.10653557 0.72379171 Ni 7.24442965 0.00135996 0.00137928 0.21464684 -0.65542415 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