32 Lattice="7.080895736008362 0.0 0.0 0.0 7.080895736008362 0.0 0.0 0.0 7.080895736008362" Properties=species:S:1:pos:R:3:forces:R:3 energy=-97.92933338988567 stress="-0.009159929442419655 0.001859282809572422 0.000696759269523815 0.001859282809572422 -0.011122190138072884 0.0003374165706664007 0.000696759269523815 0.0003374165706664007 -0.010181851000966526" pbc="F F F" Fe 0.01835076 0.00091082 0.01459628 0.20396366 0.15637083 0.11928936 Fe 1.80166271 1.73953279 0.02712976 -0.21675229 0.29937932 -0.54927701 Fe 1.77781826 0.01983443 1.76052772 -0.07776186 -0.52025474 0.29842184 Fe 0.00533260 1.75605866 1.73870079 -0.35025664 0.06096857 0.23043869 Fe 3.51629810 0.02515884 0.02699832 0.28141836 -0.23160911 -0.18310283 Fe 5.32400686 1.77661606 0.05513741 0.12606041 -0.07878289 -0.18667735 Fe 5.29880674 0.02615502 1.81192529 0.13482896 -0.22547171 -0.06366455 Fe 3.57488987 1.74486636 1.75694934 -0.26528269 0.36318679 0.44940409 Fe 0.01702599 3.51398534 0.02028370 -0.13719785 -0.12612708 -0.25351377 Fe 1.73945763 5.28560417 0.02206962 0.35661685 0.15328934 -0.23700968 Fe 1.76524021 3.57191524 1.73934925 0.17533599 -0.55040012 0.22162541 Fe 0.03443401 5.27924502 1.73540122 -0.37314240 0.17792736 0.21950466 Fe 3.56685287 3.52403976 0.02695535 -0.08000598 0.16097541 -0.50640956 Fe 5.30108853 5.33341627 0.01504802 -0.18485493 -0.27772270 0.22110496 Fe 5.29867850 3.55270341 1.78315289 0.58520219 -0.06003586 0.06329328 Fe 3.57292095 5.29193592 1.77342959 -0.19997324 0.63617257 -0.10902945 Fe 0.01506844 0.02588169 3.54692949 0.04165410 -0.02937252 -0.12403284 Fe 1.78072418 1.79450201 3.54391376 0.02445642 -0.17729830 -0.26109356 Fe 1.75022037 0.00610263 5.34024828 0.19047832 0.00859296 -0.11838192 Fe 0.03358330 1.75173360 5.29663007 -0.13607606 0.12296045 0.15388674 Fe 3.55156879 0.02131100 3.56068973 -0.25023292 -0.52364923 -0.00863555 Fe 5.31654824 1.75864377 3.57139409 0.39696557 0.25477281 -0.15771633 Fe 5.30469987 0.01295866 5.29640908 -0.12169078 0.09208681 -0.11946290 Fe 3.54687259 1.76549624 5.28549492 -0.08825563 0.14804962 0.51727480 Fe 0.01154049 3.52130847 3.54261875 -0.46918124 0.14580796 -0.00834175 Fe 1.74174194 5.29021766 3.52538840 0.04951015 0.52948774 0.20649705 Fe 1.75613541 3.55232483 5.30556545 0.05856139 0.10955575 0.46176507 Fe 0.00176821 5.34241752 5.33561114 0.34639955 -0.35471183 -0.35379555 Fe 3.51432105 3.56803429 3.51328586 0.20435565 -0.14444841 0.26979615 Fe 5.33150814 5.30872130 3.53746135 -0.12253433 0.06550309 0.07002681 Fe 5.29462622 3.56807717 5.27478937 -0.11694348 -0.01215831 0.02762095 Fe 3.51145359 5.34174136 5.34543256 0.01433475 -0.17304455 -0.28980528