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=-5.219672654646557 stress="-1.1577938004472899 0.2583349740686687 0.33107021378733925 0.2583349740686687 -0.8997329180212271 -0.051882969585982534 0.33107021378733925 -0.051882969585982534 -0.6774428021099222" free_energy=-5.219672654646557 pbc="T F T" Cr 2.73387496 0.08501927 0.33747280 10.87795094 -9.36885960 -9.47696468 Cr 1.50693356 1.66501753 0.12875416 -2.45602103 8.53545946 -0.24496596 Fe 1.42866320 0.18883157 1.49955875 -6.65912474 -7.67818795 9.10372015 Fe 0.04313966 1.44832183 1.75980354 -1.76280518 8.51158809 0.61821050