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=2.8542971832711843 stress="-22.63111670575576 5.517900116691691 0.032121426201978664 5.517900116691691 -18.491175010239495 1.4614916423660205 0.032121426201978664 1.4614916423660205 -16.10684450198878" pbc="F F F" Ni 0.03369179 0.02598936 -0.27670350 -6.01483130 -4.10738889 -4.59363951 Ni 1.46375436 1.40583543 -0.24440284 4.09424060 6.88409727 -5.35495044 Ni 1.20178472 0.29874826 1.27290972 12.92282909 -11.95173586 6.92403344 Ni -0.11909813 1.36136659 1.55835534 -11.00223838 9.17502747 3.02455651