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=265443.3958677455 stress="-1357424.928337723 -514876.6884073115 -338224.2116608976 -514876.6884073115 -931178.2378251305 172934.3061809639 -338224.2116608976 172934.3061809639 -904999.5384296414" pbc="F F F" Fr 0.17544305 0.18720750 -0.03296914 -954931.52365328 -474444.86204515 -437288.18913810 Fr 1.56656690 1.33612350 -0.14931889 660457.10610098 561063.61718385 -166335.67778671 Fr 1.30825776 -0.08012759 1.41425721 387380.23433569 -234745.92270171 502658.69021759 Fr 0.17740990 1.69812173 1.53376432 -92905.81678338 148127.16756302 100965.17670721