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=-4.640371463723086 stress="-25.746470367145875 -6.778982070623753 4.290327539893107 -6.778982070623753 -39.85282895693214 0.7013414713345192 4.290327539893107 0.7013414713345192 -42.86515448889697" pbc="F F F" Ni -0.18564671 0.11115480 0.11044915 -10.85753603 -18.16730044 -11.33543009 Ni 1.41826113 1.17693662 0.06110600 14.14103595 16.27938876 -20.85326367 Ni 1.47413972 0.01872586 1.49443895 2.44677103 -13.22948687 15.85680994 Ni -0.01190878 1.51878885 1.32834452 -5.73027096 15.11739855 16.33188383