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=1097.4510229537202 stress="-0.07325837519714556 -0.02371463794492027 0.017326835423425484 -0.02371463794492027 -0.07274108888979015 0.016563671780480016 0.017326835423425484 0.016563671780480016 -0.07342598484707104" pbc="F F F" Ts 21.11114248 21.07757347 21.09380379 -465.76682999 -472.44731649 -321.10646143 Ts 22.62345150 22.28258572 22.21389164 62.56588262 755.80026722 474.24765702 Ts 23.84260175 21.01307947 20.83031692 259.59697343 -444.24987582 -481.42979151 Ts 25.59052626 22.19173799 22.11138933 213.85884357 -22.08178383 147.67477237 Ts 20.99695165 23.58209317 20.88432073 -145.47217191 157.08836836 -153.21725399 Ts 22.28167724 25.29677872 22.37960793 1031.49222372 1194.88819567 -1227.30546813 Ts 24.41372288 23.95644808 20.82769340 -86.90151262 70.49825189 -147.70321212 Ts 25.47447847 25.60656780 22.51092269 50.20766486 69.31018252 32.43622156 Ts 21.01678230 21.27463406 24.02308253 -186.85388069 -151.93297043 -29.19708538 Ts 22.50025810 22.82034453 25.21270060 -671.87003897 -512.50278175 1020.88300814 Ts 23.74431257 21.19857310 23.95978017 289.02935549 -381.73920566 123.76365834 Ts 25.49603036 22.49681941 25.64485134 54.99838403 -16.34755107 49.34632062 Ts 21.20023554 24.11871331 23.67704387 -1290.15263438 -1030.35208876 1005.43558062 Ts 22.48837863 25.52896910 25.25999408 -23.94897487 241.74860907 196.08337922 Ts 23.91252043 23.93317150 24.05681930 895.21445744 528.15553046 -706.08873799 Ts 25.63696831 25.61767009 25.52300780 14.00225828 14.16416862 16.17741264