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=-5.456145839282023 stress="-7.488301944518646 1.928087652700979 1.687327561219563 1.928087652700979 -6.845756118003463 1.9964753774428345 1.687327561219563 1.9964753774428345 -7.669253499516383" pbc="F F F" Ni -0.01264569 -0.07700850 -0.09301634 -1.11928469 -1.09607920 -0.89333785 Ni 1.68107110 1.32825321 0.13102478 2.42835437 2.78716435 -4.46788988 Ni 1.59995250 0.26120756 1.51193751 2.76188215 -4.60104840 3.30919513 Ni 0.25226748 1.46431997 1.54396501 -4.07095183 2.90996325 2.05203261