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=-22.496393979385584 stress="-141.78267970600112 48.926146231692854 45.910936558711796 48.926146231692854 -116.43242266228054 -107.45280260653126 45.910936558711796 -107.45280260653126 -115.806890911453" pbc="F F F" Fe -0.08129564 0.04860922 0.20118821 1.07164998 0.98122139 1.16849639 Fe 1.98180132 1.24524776 1.46966436 -37.47066314 39.16505226 33.57701567 Fe 3.04808264 0.01875493 0.34330139 18.31532217 -53.19429835 -46.47639625 Fe 4.36156112 1.31464288 1.27643906 15.68511794 15.51686551 10.62314227 Fe 0.09773896 3.19066365 0.38449718 -22.76557640 -17.05496448 -14.82026331 Fe 1.56504129 4.20865944 1.36550211 -25.78408187 56.69192726 53.89627206 Fe 2.78802619 3.22277084 0.18584377 44.84550435 -35.93986287 -43.13873861 Fe 4.50546308 4.62067295 1.77675675 -1.11851799 -0.98571368 0.60999674 Fe 0.05179855 0.45904430 2.91612479 0.82962839 0.61055058 -0.68300333 Fe 1.84359200 1.31910071 4.56861299 -0.10345620 0.55176074 -1.05382522 Fe 3.17509931 -0.13745308 2.79571662 0.28836673 -2.11412193 1.76569638 Fe 4.25658342 1.49867558 4.03777214 0.04441799 1.18304076 0.09586229 Fe 0.02712063 2.92044154 3.37752479 1.13543434 -0.40367204 -0.67062085 Fe 1.64824538 4.55852517 4.37234339 0.05978497 -0.80000438 -0.64763592 Fe 2.74466662 3.01192837 2.72163713 5.15783386 -3.48711532 6.66409216 Fe 4.00776497 4.62032424 4.28652570 -0.19076511 -0.72066546 -0.91009048