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=6.69462069287675 stress="-25.62961185552526 5.2443692417621826 -1.8895556525546766 5.2443692417621826 -27.98288427370866 1.162482632270315 -1.8895556525546766 1.162482632270315 -23.735149814634077" pbc="F F F" Fe -0.12320595 -0.04105180 0.20259391 -9.24949628 -6.31733061 -5.88783163 Fe 1.56504129 1.20865944 -0.13449789 6.70654714 5.48199448 -8.32112822 Fe 1.28802619 0.22277084 1.68584377 12.24833592 -13.36079894 10.48343417 Fe 0.18362810 1.69581920 1.64685009 -9.70538677 14.19613507 3.72552568