108 Lattice="10.697521051322122 0.0 0.0 0.0 10.697521051322122 0.0 0.0 0.0 10.697521051322122" Properties=species:S:1:pos:R:3:forces:R:3 energy=-357.7016431363644 stress="-0.0074229996967513385 -0.00043212464432254756 9.876378504272175e-05 -0.00043212464432254756 -0.006865129908244835 0.0005532079219589082 9.876378504272175e-05 0.0005532079219589082 -0.007205040594345078" free_energy=-357.7016431363644 pbc="F F F" Fe 0.02035628 0.00048036 0.00359642 0.64097207 0.61189824 0.63048756 Fe 1.81363310 1.75982630 0.02836849 -0.29035890 0.07421929 -0.64053011 Fe 1.80684666 0.01329345 1.81412526 -0.14840108 -0.65701989 -0.09291934 Fe 0.01866243 1.75761056 1.79761939 -0.58741370 0.05015164 -0.18537096 Fe 3.55410665 0.00601106 0.03209108 0.00453278 -0.05554449 -0.00464339 Fe 5.31409432 1.78594078 0.02304717 0.11133237 0.06671233 -0.58514781 Fe 5.35960892 0.00127769 1.76217526 -0.03634056 -0.40946578 0.28778867 Fe 3.53019405 1.79728901 1.77775631 0.26911017 0.12761147 0.28225775 Fe 7.14127715 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3.59179280 1.83550890 8.93503398 -0.08937283 -0.08029534 0.28988454 Fe 7.15077347 0.02035739 7.10347485 -0.05576338 -0.56061485 0.23699338 Fe 8.89985688 1.81341557 7.16516351 0.64251585 -0.14239108 -0.09246479 Fe 8.88315943 0.02668679 8.90888841 -0.55867154 0.56391443 -0.55557401 Fe 7.15744368 1.83509464 8.94272082 -0.11579751 -0.17408885 0.44982394 Fe 0.01639256 3.59295400 7.13115802 -0.43636160 -0.19111784 -0.06494008 Fe 1.80607785 5.34913197 7.12075400 0.12427924 0.10500288 -0.25875960 Fe 1.80761892 3.56439381 8.88686148 -0.16184009 -0.13761974 0.55685444 Fe 0.03854490 5.36661709 8.91310967 -0.03223517 -0.12203137 0.01695415 Fe 3.53918708 3.58763014 7.13872116 0.13878789 -0.33269972 -0.56857610 Fe 5.32487591 5.31725531 7.13521184 0.27045345 0.22191203 -0.25996542 Fe 5.35604896 3.58401844 8.90046179 0.12393669 -0.11397950 0.45642083 Fe 3.57048953 5.31353712 8.91270458 -0.04635553 0.27590153 0.54700729 Fe 7.14955348 3.54799753 7.07898585 -0.30098088 0.19603108 0.17822632 Fe 8.90106018 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