32 Lattice="12.866561889648438 0.0 0.0 0.0 12.866561889648438 0.0 0.0 0.0 12.866561889648438" Properties=species:S:1:pos:R:3:forces:R:3 energy=-17.96133489431418 stress="-22.303389752343875 0.3271679133597445 -0.854921273582661 0.3271679133597445 -22.02954868893696 -0.9210963687054452 -0.854921273582661 -0.9210963687054452 -23.02481064029196" pbc="F F F" Ba -0.12049575 0.09262900 0.09204096 -0.15883759 -0.23176510 -0.26090145 Ba 3.41938505 3.05950256 -0.13472070 -0.10096785 0.42616652 -0.23409788 Ba 3.04022043 -0.13741853 3.35531007 0.26724107 -0.27328129 0.15472496 Ba -0.18489349 3.23229785 3.07359424 -0.28311230 0.16428186 0.19693426 Ba 6.10002307 -0.03420984 0.16882826 0.21124853 -0.45590479 -0.21754244 Ba 9.70412249 2.97385667 -0.11208157 0.18235859 0.17292024 -0.26842241 Ba 9.47327658 0.18564236 3.37151028 0.29725017 -0.66490862 -0.23566224 Ba 6.58630436 3.37982314 3.30881085 -0.58735582 -0.11429512 0.11950943 Ba 0.22466171 6.58016622 -0.12164601 -0.35605034 -0.32758681 -0.49022793 Ba 3.31313951 9.64331416 0.12750193 0.03657957 0.46457460 -0.59182672 Ba 3.04504074 6.39806977 3.14874179 0.39470056 -0.52165213 0.17263317 Ba -0.03508886 9.55680210 3.02532050 -0.37556955 0.51940958 0.20268193 Ba 6.59310277 6.58241026 0.24284059 -0.29736950 -0.39140531 -0.76600778 Ba 9.74538274 9.67703460 0.12420575 0.17408222 0.29369608 -0.15170378 Ba 9.46734830 6.52169173 3.18834045 0.75275299 -0.19325778 0.21296048 Ba 6.02308509 9.50123473 3.22798712 0.31883400 0.68210759 0.33940852 Ba -0.12334412 -0.02027049 6.48603033 -0.44487166 -0.29434441 -0.20830548 Ba 3.16451916 3.03203095 6.42870951 0.21619267 0.44825689 -0.24500419 Ba 3.08436397 -0.13216084 9.49715589 0.12644756 -0.45532878 0.37864554 Ba -0.06678005 3.00327836 9.72553730 -0.24110679 0.36171172 0.23620136 Ba 6.66011397 -0.05515562 6.79167883 -0.35919552 -0.36659441 -0.33310842 Ba 9.86641033 2.98824474 6.25415373 0.36948554 0.59602114 0.28670565 Ba 9.80296906 0.16907269 9.71944917 0.23159354 -0.09515677 0.32607424 Ba 6.07391740 3.17338592 9.83404218 0.11706072 0.29113633 0.28011489 Ba 0.19309621 6.58486701 6.18556165 -0.56768871 -0.40212564 0.20327660 Ba 3.27793974 9.58729954 6.54153649 0.02474844 0.60760536 -0.27820976 Ba 3.03514422 6.66893259 9.70167142 0.22426845 -0.72348480 0.37079052 Ba 0.11135716 9.50577926 9.70854167 -0.47025356 0.39526963 0.20730345 Ba 6.47371822 6.47889344 6.36295651 -0.35652576 -0.43766736 0.02073468 Ba 9.76376821 9.57058836 6.37957293 0.19696051 0.45174258 -0.15666099 Ba 9.48216313 6.52529658 9.45605151 0.39152669 -0.41466097 0.37887695 Ba 6.29605965 9.43449338 9.72168482 0.06557315 0.48851997 0.35010483