32 Lattice="7.053358994482674 0.0 0.0 0.0 7.053358994482674 0.0 0.0 0.0 7.053358994482674" Properties=species:S:1:pos:R:3:forces:R:3 energy=-93.52946036702852 stress="-0.011536978804966642 -0.001452772041780563 -0.0006587261735216991 -0.001452772041780563 -0.012711710516820329 -0.0010911682558218908 -0.0006587261735216991 -0.0010911682558218908 -0.01234331460758485" free_energy=-93.52946036702852 pbc="F F F" Fe 0.01537846 0.00768761 0.03158909 0.42457172 0.48798786 0.42680439 Fe 1.79844056 1.74400598 0.03511960 -0.27525227 0.39962764 -0.88419454 Fe 1.76858710 0.01030830 1.73864669 -0.11177492 -0.86871029 0.33108099 Fe 0.01875556 1.78929535 1.79618690 -0.78230982 -0.23704330 -0.23434524 Fe 3.50330504 0.01596581 0.01577323 0.11716400 -0.19923328 -0.13021272 Fe 5.30321023 1.75231675 0.05599730 0.00244540 0.24230654 -0.14150013 Fe 5.31713660 0.01031577 1.74425375 -0.06128975 -0.04490271 0.27327493 Fe 3.50199296 1.76422695 1.76500206 0.20659477 0.25305555 0.20751204 Fe 0.03352290 3.53600314 0.04082928 -0.03955344 -0.23179310 -0.12185926 Fe 1.80038091 5.27562019 0.02648440 -0.08208333 0.13534770 -0.33365116 Fe 1.75656711 3.54839182 1.81266216 0.33933606 -0.38776570 -0.19164144 Fe 0.03896529 5.28900804 1.76191494 -0.21625250 0.17477711 0.18533236 Fe 3.55732680 3.55168865 0.01806943 -0.06443406 -0.38299488 -0.72515846 Fe 5.28521157 5.26324759 0.02139918 -0.35519192 -0.38390952 0.47404184 Fe 5.32246444 3.50220774 1.80799809 0.60375927 0.13940858 -0.18129273 Fe 3.49146133 5.26391883 1.73087312 0.41527638 0.83400962 0.42373547 Fe 0.03313038 0.02016665 3.55039557 -0.00838614 -0.13170468 -0.20987281 Fe 1.76804320 1.77130170 3.52043482 0.35073601 -0.04949601 0.11065369 Fe 1.79084557 0.00187689 5.32004694 0.21853513 0.09580041 -0.13051921 Fe 0.03366146 1.76095717 5.27151845 -0.12632715 0.11309848 0.17765265 Fe 3.54644199 0.01346293 3.50126047 -0.04715918 -0.64835853 0.15374330 Fe 5.30361507 1.77144130 3.52564429 0.72030341 -0.29573615 -0.06338537 Fe 5.32236845 0.01947574 5.27510911 -0.55132885 0.51650516 -0.50495603 Fe 3.54937025 1.78646347 5.29679644 -0.27451756 -0.40454844 0.65282324 Fe 0.01721898 3.50277712 3.51645074 -0.82991004 0.24016475 0.22371799 Fe 1.76574183 5.30174444 3.51114106 0.17596061 0.63479899 0.29091797 Fe 1.76099778 3.50924985 5.32026392 0.13810784 0.12621566 0.49842786 Fe 0.02339491 5.26293808 5.25575947 0.41234399 -0.41859869 -0.41538774 Fe 3.55881781 3.51020736 3.53536772 -0.45380229 0.07670969 -0.21169256 Fe 5.26638523 5.29514925 3.50575856 -0.00685649 0.03011115 -0.11595901 Fe 5.25651769 3.47367512 5.28195010 0.41676442 0.18268929 0.20179082 Fe 3.55166221 5.26283730 5.29524684 -0.25546932 0.00218109 -0.03588111