32 Lattice="7.080893545401624 0.0 0.0 0.0 7.080893545401624 0.0 0.0 0.0 7.080893545401624" Properties=species:S:1:pos:R:3:forces:R:3 energy=-98.00425702565971 stress="-0.007223247279454976 0.00019788511368927356 -0.0018439026066918909 0.00019788511368927356 -0.006251311938554513 -0.00032031508556996816 -0.0018439026066918909 -0.00032031508556996816 -0.007587378319513375" free_energy=-98.00425702565971 pbc="F F F" Fe 0.03428263 0.00245446 0.01850435 0.16962370 0.31097021 0.15909167 Fe 1.80558499 1.80117031 0.02730431 -0.32096222 -0.10555005 -0.54078418 Fe 1.74553432 0.03128860 1.75028298 0.15048495 -0.45092563 0.07023580 Fe 0.00265246 1.79930336 1.77510075 -0.44247908 -0.17001274 -0.14910626 Fe 3.56722110 0.02242706 0.05261966 -0.13075760 -0.13445319 -0.16242943 Fe 5.31995051 1.77255110 0.01173836 0.03436231 0.13846584 -0.08778875 Fe 5.31668720 0.03325059 1.76944015 0.05348437 -0.03928858 0.21082812 Fe 3.55196518 1.79908219 1.74527796 -0.16648389 -0.16593113 0.42402732 Fe 0.00943290 3.56747878 0.01689263 -0.07077520 -0.10042951 -0.12792236 Fe 1.78351501 5.30104495 0.02250149 -0.06703102 0.14443385 -0.09222936 Fe 1.73546990 3.56899232 1.76661713 0.44089853 -0.29764060 0.19573201 Fe 0.01175936 5.28632251 1.80405445 -0.21344768 0.20327375 -0.11523078 Fe 3.53832923 3.55956040 0.02860445 0.12726919 0.07399294 -0.52978086 Fe 5.29015427 5.31983623 0.02897808 -0.16955647 -0.17587990 0.15725183 Fe 5.28443345 3.54864109 1.77083405 0.54368362 0.17885124 0.03953994 Fe 3.53457294 5.34309072 1.76256700 0.09174216 0.27634130 0.17755873 Fe 0.02907456 0.00967147 3.54855417 -0.12315984 -0.05241558 -0.00887308 Fe 1.74916122 1.73536845 3.55586503 0.16178780 0.40352250 -0.11544933 Fe 1.76283572 0.00385588 5.33732455 0.05643809 -0.04033430 0.03786687 Fe 0.00955532 1.76770107 5.33636985 -0.00570743 0.04813153 -0.02753721 Fe 3.51452092 0.01710809 3.54041341 0.21512998 -0.29358191 -0.00446431 Fe 5.30944928 1.78524969 3.54177592 0.31348664 -0.19410895 0.08258144 Fe 5.33066399 0.01080561 5.29612032 -0.38431486 0.36690431 -0.32357972 Fe 3.51551699 1.78948870 5.31431981 0.18286668 -0.13245469 0.35899213 Fe 0.00823436 3.53103603 3.54518452 -0.52097668 -0.04100596 0.15581258 Fe 1.76444091 5.29620526 3.51748029 0.13083817 0.50236224 0.29597209 Fe 1.73619884 3.56785024 5.29436769 0.26595100 -0.10888167 0.39977103 Fe 0.01237513 5.27631734 5.32241237 0.12143650 -0.09815748 -0.26609081 Fe 3.54016715 3.52248493 3.53608757 -0.11225289 0.26228719 0.08507384 Fe 5.29955719 5.33022588 3.55867993 -0.08231855 -0.17636692 -0.08471527 Fe 5.33839925 3.52112502 5.31472256 -0.16227412 0.09051247 -0.09662953 Fe 3.55556745 5.32025438 5.31503544 -0.08698613 -0.22263057 -0.11772415