32 Lattice="44.29252243041992 0.0 0.0 0.0 44.29252243041992 0.0 0.0 0.0 44.29252243041992" Properties=species:S:1:pos:R:3:forces:R:3 energy=-87.03293037676629 stress="-0.0003939530860229406 2.6743480544922466e-05 -0.0003052605752379327 2.6743480544922466e-05 -0.00044760869883164696 6.946677753902432e-05 -0.0003052605752379327 6.946677753902432e-05 -0.00029323781622485416" free_energy=-87.03293037676629 pbc="F F F" N 22.02576546 22.23889021 22.23830217 2.16269508 4.24116518 5.69201136 N 23.93088159 23.57099910 22.03319832 -6.95207139 3.38557513 -0.72123733 N 23.55171698 22.00884268 23.84514882 -3.29548403 1.76621170 -3.24451271 N 21.96136773 23.74379439 23.58509078 1.88985381 -5.09990308 -3.76125085 N 24.97675494 22.11205138 22.28488477 3.17322268 -4.52146438 2.81509832 N 26.94608969 23.48535321 22.03417964 -1.20234401 -2.29339890 2.23392075 N 26.71524378 22.33190358 23.88300682 -4.25070445 -7.48560232 -9.05409881 N 25.38456576 23.89131969 23.64684306 -1.43002251 -14.53250617 3.71657741 N 22.37092292 25.45689809 22.02461520 2.92679479 2.54768711 4.63740970 N 23.90310652 26.88528136 22.02525041 -3.77541564 -3.08325906 2.73415598 N 23.76020632 25.52375853 23.66023833 -12.70591922 -2.86977255 -4.68814695 N 22.11117235 26.79876930 23.53681704 2.49390001 -3.51043141 -3.87966554 N 25.46983464 25.26990023 22.38910181 -6.40169573 6.71521104 -20.45673540 N 26.88810150 26.91900180 22.15493912 -0.72407351 -2.12694950 1.08703101 N 26.70931550 25.39842360 23.69983699 17.34813969 6.84249325 7.23019966 N 25.19695915 26.74320193 23.73948367 4.30726478 15.15828916 -5.79839130 N 22.02291709 22.12599073 25.36276221 5.64807693 4.00593837 2.35718141 N 23.67601570 23.54352750 25.30544139 -1.60206603 -4.83508792 2.23137818 N 23.59586051 22.01410038 26.73912309 -2.89516149 5.93745153 -1.57137799 N 22.07948117 23.51477491 26.96750450 2.52666173 -5.92068716 -4.10906647 N 25.53684584 22.09110560 25.41945381 4.04352082 2.14028341 1.63995695 N 27.10837753 23.49974129 25.13088560 3.52258791 3.88006355 13.59531578 N 27.04493626 22.31533390 26.96141638 -3.23669509 1.54255174 -4.87242660 N 24.92860482 23.68488247 27.07600938 -1.72655766 -3.59808500 -2.27277290 N 22.32430269 25.39494775 25.32879366 -7.78842790 0.58166053 -4.95714839 N 23.90496413 26.82926674 25.41826836 -6.43769336 11.76842032 -6.06509828 N 23.54664077 25.54566446 26.69649661 8.60574083 -6.59650990 13.38457306 N 22.25761837 26.74774646 26.86788525 -5.04430966 2.97201292 -0.93419540 N 25.34872965 25.59051896 25.23968839 8.31458410 -3.72843502 10.16033282 N 27.01407867 26.81255556 25.20767535 -0.78235000 -2.98852525 1.99932983 N 26.72413034 25.40202845 26.69801871 -1.84801192 2.42352656 -2.46602187 N 25.17279152 26.67646058 26.96365202 5.13596044 -2.71792388 3.33767458