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=-19.022226865987527 stress="11.170109675216631 -2.250983435492332 0.8675667798145605 -2.250983435492332 9.553996768409027 -1.3688597540185192 0.8675667798145605 -1.3688597540185192 15.138054790529878" pbc="F F F" Mn -0.01546661 0.10170120 -0.12206635 3.29757839 2.03593734 4.37484261 Mn 1.21904386 1.50082602 0.24624097 -3.76694663 -3.46652281 5.80147277 Mn 1.64302402 -0.14501107 1.61042859 -4.62163194 4.33095273 -4.00439192 Mn 0.20947124 1.35512851 1.55280714 5.09100018 -2.90036725 -6.17192346