16 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=-70.91916215308369 stress="-0.0021330842748995184 0.0007521426383286211 0.0003588402745516518 0.0007521426383286211 -0.0018174959835657537 -0.0007886364204888114 0.0003588402745516518 -0.0007886364204888114 -0.002156799173495911" free_energy=-70.91916215308369 pbc="F F F" W 21.49461397 20.72446103 21.08305370 0.62671152 0.95120998 1.41119317 W 22.49793547 22.78187239 22.40364033 -4.06324553 -31.35968573 11.20497892 W 24.22027196 21.12894292 21.09876657 -3.93186214 -4.89048078 -4.92009854 W 25.21904386 22.50082602 22.74624097 34.39481338 -22.05175719 -19.23990197 W 21.14302402 23.85498893 21.11042859 -18.35080397 9.68606206 -17.50705870 W 22.49932090 25.35512851 22.54016144 1.86640940 8.65552627 -0.26313946 W 23.83633033 23.75353857 20.87241235 8.23331675 6.24997688 -11.33558319 W 25.15056165 25.42242911 22.47513168 2.35095160 2.32635088 -0.43977570 W 20.90290070 20.79601921 24.22724925 0.05506468 1.00663504 -1.92539588 W 22.76367877 22.20245745 25.43353263 -25.04556481 32.54462633 38.90590872 W 23.59655425 20.98844065 24.05308749 20.98229413 -34.75855873 -37.41118251 W 25.27942751 22.65077664 25.33968792 7.59965416 -4.43471705 7.94453672 W 20.91835389 23.98243153 23.89684287 -3.65629528 -1.32028699 4.37535082 W 22.91390763 25.28557440 25.45529134 -7.71363252 0.71486088 0.26000347 W 23.93300593 23.72002482 23.77696427 -19.87620111 36.17147547 29.57296494 W 25.29087417 25.23077038 25.61094162 6.52838975 0.50876268 -0.63280081