16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-41.0420924820959 stress="18.04377282046579 1.1868689104288812 -1.459081833220262 1.1868689104288812 22.28337487650709 1.406446618976661 -1.459081833220262 1.406446618976661 18.024651196945676" pbc="F F F" Fe -0.08013605 -0.25603453 0.09073906 1.13703919 1.36720931 1.37802739 Fe 1.77219963 1.43381326 1.63132919 -1.92850744 -1.77520291 -2.23280970 Fe 3.25978669 -0.27407488 -0.21495266 -0.61524264 1.64908390 1.80253451 Fe 4.68365717 1.70288723 1.46433518 -1.00137518 -0.21680726 0.59728279 Fe -0.20414597 2.94809454 0.22094491 1.14158543 -0.85082988 1.18121455 Fe 1.59308205 4.68190327 1.32183498 -0.02347444 -1.49397502 0.73270830 Fe 3.21219253 2.92485375 0.12990665 -0.64897042 -0.17166930 0.26030439 Fe 4.28220450 4.78278197 1.56210000 -0.72676631 -1.17543554 0.58159784 Fe 0.13362859 -0.17297059 3.07034430 0.98564630 1.18389181 -1.01133677 Fe 1.54852473 1.55473499 4.41561068 0.21498160 0.06334257 -0.57915475 Fe 3.13661615 -0.09519967 2.87719504 -0.45865189 0.81903551 -0.60145436 Fe 4.29869006 1.61041876 4.26735611 -0.60146736 0.77046364 -0.69975016 Fe -0.16466555 2.79984170 3.08611608 1.33317619 -0.21035297 -1.00925567 Fe 1.53369179 4.52598936 4.22329650 0.45082684 -0.81342384 -0.75265021 Fe 2.71021073 2.90583543 2.75559716 1.60824278 2.02188494 1.31882480 Fe 4.20178472 4.79874826 4.27290972 -0.86704265 -1.16721496 -0.96608296