32 Lattice="7.08089549120705 0.0 0.0 0.0 7.08089549120705 0.0 0.0 0.0 7.08089549120705" Properties=species:S:1:pos:R:3:forces:R:3 energy=-97.91220570555049 stress="-0.3829235591464505 -7.737074822034007e-05 -0.2182020851549331 -7.737074822034007e-05 -0.7105492870580736 -0.09943836995438282 -0.2182020851549331 -0.09943836995438282 -0.9649120251889933" pbc="F F F" Fe -0.03427559 -0.02896185 -0.00902022 0.40240894 0.40636850 0.45068944 Fe 1.74900356 1.75421066 0.00401487 -0.22945675 -0.08974638 -0.36034397 Fe 1.79923083 -0.03363825 1.74558048 -0.43062856 -0.13444982 -0.00771369 Fe -0.01070584 1.80364248 1.79843276 -0.19963245 -0.25674398 -0.21126868 Fe 3.52307926 0.00051091 0.02362129 0.14041077 0.03577527 -0.09980615 Fe 5.26894212 1.80525851 -0.01930263 0.07277904 -0.18228054 -0.13972337 Fe 5.31571152 0.03309439 1.74764241 -0.07828735 0.05516883 0.04312422 Fe 3.54893657 1.80051141 1.75637845 -0.16762565 -0.45366691 -0.01742422 Fe -0.02826239 3.59287103 0.02380879 0.14942879 -0.14232415 -0.01942226 Fe 1.79332931 5.32922378 -0.00698614 -0.08157021 -0.06516184 0.17188340 Fe 1.78187027 3.51538528 1.74130744 -0.28506138 0.28618383 0.28377280 Fe 0.00621921 5.28626934 1.80109851 0.03718909 0.08845435 -0.13782825 Fe 3.51906521 3.54236769 0.03013380 0.14429410 0.22191089 -0.60780086 Fe 5.29678816 5.32536857 -0.02926803 -0.34520152 -0.38557023 0.34227229 Fe 5.32744515 3.51049016 1.74027839 0.44519556 0.35250430 -0.10144571 Fe 3.56152755 5.31088625 1.77529731 -0.03367971 0.33894253 -0.17495703 Fe 0.03278141 0.03429237 3.54387886 0.01960316 -0.19961963 -0.15330971 Fe 1.80468694 1.74260643 3.55454524 -0.21536138 0.35067231 -0.33514236 Fe 1.79881100 -0.01695486 5.30601395 -0.05109368 0.00517965 0.10427097 Fe 0.02648893 1.77109285 5.26187549 -0.10183655 -0.06549890 0.16793644 Fe 3.51179023 0.00473528 3.52337332 0.46693972 -0.38388513 0.13072532 Fe 5.27598042 1.78411082 3.51406069 0.42015578 -0.21675913 0.45816137 Fe 5.32812158 -0.03317775 5.31824665 -0.51821043 0.47846095 -0.46795146 Fe 3.51123644 1.80229317 5.30839522 0.40847995 -0.30141686 0.38940220 Fe -0.03179123 3.56181682 3.55434356 -0.15051362 -0.04217167 0.08077292 Fe 1.75935286 5.29454313 3.53150901 0.08475435 0.19517007 0.30263621 Fe 1.73963046 3.51516143 5.34497789 0.09948299 0.46359190 0.10488745 Fe -0.02494451 5.30812396 5.33244439 0.33401607 -0.28884269 -0.32348811 Fe 3.54806136 3.53384470 3.50698221 -0.22686494 0.21805898 0.33428780 Fe 5.30173308 5.26167802 3.51707390 0.14976406 0.08529161 0.01349330 Fe 5.28459384 3.57481602 5.31737411 0.00293188 -0.19995630 -0.02903074 Fe 3.57519689 5.34190146 5.31303811 -0.26281008 -0.17363980 -0.19165954