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=340.1260020228513 stress="-0.009275090269656864 -0.0002814239678124557 0.0002758452197537439 -0.0002814239678124557 -0.009207344393405424 -2.210529022659682e-05 0.0002758452197537439 -2.210529022659682e-05 -0.009484962271133525" free_energy=340.1260020228513 pbc="F F F" Li 20.77460958 21.20876017 20.93759557 -8.88229227 -15.24245257 -17.46659813 Li 22.49350828 22.78842942 20.82347155 -16.74358231 -13.85713462 -31.86682779 Li 22.53982750 21.21736712 22.62073407 -6.02477067 -36.17998266 -13.24601674 Li 20.96333106 22.31913022 22.31434235 -34.07137465 1.15095381 5.86752351 Li 23.87074974 21.20270815 21.27898347 2.53653034 -39.69267936 -38.54119972 Li 25.42478403 22.59576093 20.90229474 20.16500283 -3.50120171 -19.48747931 Li 25.71823327 20.85744396 22.30952440 14.73589349 -12.04104223 1.80798945 Li 23.88918897 22.25190098 22.28818294 16.04693873 24.94430224 24.44931836 Li 20.83922355 24.34012855 21.25742332 -26.72269025 -12.90204053 -26.43761795 Li 22.35528985 25.37586444 21.05215589 10.39031408 20.86378141 -16.59791370 Li 22.21786022 23.49917464 22.49898856 11.63438316 17.47176161 9.60366957 Li 20.97882658 25.41081559 22.47986749 -14.99842220 30.09720677 12.74307318 Li 23.71178728 23.85587493 20.80634031 12.24666397 16.24718757 -19.60362460 Li 25.34324059 25.24192238 21.18946557 11.71087572 21.41624903 -17.15108821 Li 25.20975770 23.94867012 22.30315192 14.69354256 -4.13641468 12.11446557 Li 23.82206028 25.65571493 22.77666978 11.46861863 22.39206368 -22.27573526 Li 21.27925960 20.89867783 23.90801329 -27.67546753 -23.85685950 7.48876133 Li 22.45903020 22.24802762 23.95375095 6.20444081 21.26122702 22.58764762 Li 22.41125762 20.93927127 25.67093812 -0.48519623 -15.24331327 17.00666028 Li 20.96777718 22.54725274 25.73720612 -13.26570531 -1.10593172 9.61320863 Li 24.04213952 20.85313536 24.06825881 6.20955260 -20.41177526 1.98792857 Li 25.48785390 22.56179810 23.98101872 15.78281435 -5.43261126 -7.02506634 Li 25.71531963 21.13900143 25.46542365 12.04160434 -10.05192252 10.20967123 Li 23.95128722 22.37529860 25.70242272 -1.12185854 4.97997941 16.82767583 Li 21.06139068 24.22370094 23.99373494 -20.33646642 -11.99634345 -2.10301116 Li 22.72762194 25.39006667 23.86150648 -18.58677839 17.72450966 10.96034314 Li 22.29185975 24.25386859 25.53152318 9.01898293 -8.34267233 20.20650436 Li 20.75008333 25.32523637 25.45446512 -16.78458330 18.32045040 13.44578032 Li 24.18364777 24.21362006 24.15569519 -21.24346605 -21.94309573 -10.98069616 Li 25.37564235 25.45625491 24.26845365 27.71179285 35.78705710 -11.57978981 Li 25.43256865 24.08972426 25.23017696 28.75392833 -14.23637895 34.08995745 Li 23.98792116 25.50385152 25.74566581 -4.40922561 17.51712266 23.35248649