32 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=104.10247284362835 stress="-0.006166549791332203 0.0001676258099329338 -0.0004044067207618904 0.0001676258099329338 -0.005620570786393818 -0.0003710521021099693 -0.0004044067207618904 -0.0003710521021099693 -0.006297948060664422" free_energy=104.10247284362835 pbc="F F F" Fe 20.85540510 21.11115480 21.11044915 -4.83122374 -10.15937680 -10.86495614 Fe 22.70960170 22.31143450 20.83833517 -4.82694804 8.31874758 -8.44719407 Fe 22.28829595 20.83509776 22.67410596 5.91309747 -15.97081236 -7.40108955 Fe 20.77812781 22.51878885 22.32834452 -8.89809478 7.68719229 4.89920877 Fe 23.90278341 20.95894820 21.20259391 -1.77334901 -16.80543292 -4.20239286 Fe 25.56504129 21.93195593 20.86550211 10.07501335 7.55845299 -10.83956798 Fe 25.28802619 21.22277084 22.68584377 9.45768280 -31.22746982 -22.66378982 Fe 24.18362810 22.69581920 22.61060445 -15.03369136 -11.22803999 -3.18867848 Fe 21.26959405 24.17626233 20.85402479 -10.35845622 -9.42378793 -18.42830643 Fe 22.70996341 25.49207130 21.15300231 -4.75565670 20.57742073 -21.75329504 Fe 22.53848316 23.95774659 22.32435701 -4.49001168 -16.02108711 4.73788720 Fe 20.95789336 25.38825682 22.27041603 -12.25083639 17.35788798 3.40862700 Fe 24.19178619 24.17895518 21.29140871 -7.76090028 -16.54008388 -44.83190051 Fe 25.61455359 25.53253581 21.14904689 9.65089877 12.16158438 -8.48070566 Fe 25.28091226 24.10609294 22.46603997 40.23631568 -10.09619005 7.75223836 Fe 23.80598025 25.32157598 22.51361598 4.36414647 34.03949377 14.91112724 Fe 20.85198705 20.97567541 24.06329927 -17.14834219 -8.72168380 -5.00298207 Fe 22.43745442 22.27846858 23.75011144 5.56267706 14.39526008 8.80146774 Fe 22.34126820 20.84140700 25.31668137 8.52192854 -10.35536364 9.61049268 Fe 20.91986395 22.24396547 25.59073906 -6.00399409 10.33858463 8.16639149 Fe 24.27219963 20.93381326 24.13132919 -15.18229236 -13.77533877 4.42647428 Fe 25.75978669 22.22592512 23.78504734 22.94605751 24.67606714 23.05712821 Fe 25.68365717 20.90467195 25.58343331 9.23803372 -5.45663241 7.03865320 Fe 24.09460229 22.22100426 25.72094491 -5.52242395 8.16477099 6.96541014 Fe 21.23171545 24.18190327 23.70273684 -14.06986473 -9.36789249 8.79919122 Fe 22.71219253 25.42485375 24.12990665 -6.40926239 22.54421473 -11.10288417 Fe 22.28220450 24.28278197 25.56210000 13.16910575 -37.77806269 12.96119640 Fe 21.13362859 25.32702941 25.57034430 -29.28447274 24.41194006 5.94831436 Fe 24.04852473 24.05473499 23.91561068 -9.35045826 -13.62325947 10.16632259 Fe 25.63661615 25.40480033 23.73856164 10.96435751 16.99285938 5.18140838 Fe 25.29869006 24.11041876 25.26735611 17.86982901 -9.17363424 12.79568506 Fe 23.83533445 25.24148635 25.58611608 9.98113531 16.49967164 17.58051848