16 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-35.56583460023038 stress="-0.0014597846814373015 -0.0008440878235711912 1.2357520321759852e-05 -0.0008440878235711912 -0.0014772991242289562 0.0005300451489111838 1.2357520321759852e-05 0.0005300451489111838 -0.0017095447964364536" pbc="F F F" Fe 20.91794122 21.23886177 20.87348662 -9.53786653 -6.16609784 -10.60082536 Fe 22.38469984 22.09194450 22.43034316 14.60758181 15.47552551 8.88797194 Fe 23.75219534 20.83418466 20.82324755 1.95283311 -0.06377624 -0.77958223 Fe 25.35470740 22.34796277 22.79899846 29.97565727 37.77501511 -31.11295853 Fe 20.86782164 23.83884466 21.29231718 1.26822618 0.60244791 -6.07909235 Fe 22.63062049 25.35351009 22.73153902 -8.62648439 14.16299655 -15.72443011 Fe 23.59757105 23.70427718 20.87492776 0.48818933 -0.42017612 2.08378572 Fe 25.43090151 25.62260915 22.82582777 -1.68393360 -1.55191063 -0.42805745 Fe 20.97002617 21.18076767 24.08615378 -24.08501506 -24.30277814 -10.68336781 Fe 22.23491001 22.60427711 25.22713764 22.00287199 12.22331369 24.17088840 Fe 24.08872471 20.96733477 23.84480067 -33.55422299 -36.17995476 28.90127451 Fe 25.59588714 22.52329998 25.30892763 -0.64782209 1.75178488 2.11395622 Fe 20.91761884 23.87509764 23.71486320 -6.08928080 2.35361778 2.21686090 Fe 22.85749796 25.61737599 25.61823246 -6.76304243 6.57842728 5.76980747 Fe 23.83161966 24.06761940 24.15565694 18.28409563 -22.27108762 0.26608647 Fe 25.43109601 25.48184595 25.45926656 2.40821259 0.03265265 0.99768220