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=189.9767398463904 stress="-0.015168022218610237 0.00027942330453433866 0.00023730372376526865 0.00027942330453433866 -0.014335403602494128 -0.00016601651483330563 0.00023730372376526865 -0.00016601651483330563 -0.016055455055815057" free_energy=189.9767398463904 pbc="F F F" Ta 20.92001865 21.20070203 20.70342959 -12.70898111 -17.12164012 -20.24392173 Ta 22.40085166 22.49793547 21.28187239 -28.83482928 -20.58061979 -67.77426242 Ta 22.51001192 20.98453339 22.60170120 25.83867602 -71.07487472 -30.83999163 Ta 20.87793365 22.21904386 22.50082602 -60.74310234 48.09653499 -43.46158824 Ta 24.24624097 21.14302402 20.85498893 -4.39797163 -27.35985865 -28.89356286 Ta 25.61042859 22.70947124 20.85512851 26.93836914 -11.55025670 -31.53379384 Ta 25.55280714 20.91333883 22.54645214 21.35981752 -16.20015304 -2.99718401 Ta 23.87241235 22.32230844 22.41049160 45.44291540 -33.43370505 18.49218774 Ta 20.72286420 24.06819272 20.75205420 -10.98125932 -1.63121867 -10.51716332 Ta 22.52914642 25.55988540 20.70245745 -5.32750191 14.87230214 -18.11194810 Ta 22.66431082 23.81425730 22.48844065 -79.60465132 29.84200107 25.79841829 Ta 21.03277713 25.39971974 22.53086542 -19.45777983 23.05355008 -12.70991397 Ta 23.72662520 23.78219307 21.21813893 33.96846117 25.48544484 -89.96949374 Ta 25.26716069 25.69410236 20.83096497 7.63811186 9.71452397 -11.07336869 Ta 25.38201197 23.93300593 22.22002482 44.07387374 18.27008810 23.91163619 Ta 23.77696427 25.41661558 22.46512192 27.55587583 41.57663556 -30.88861796 Ta 21.22586561 21.29391194 23.72614529 -66.71327468 -87.05658746 47.32491305 Ta 22.52103145 22.27761356 24.06727805 37.27732491 48.95934159 13.75598489 Ta 22.39362841 21.23573857 25.52724172 13.20822062 -40.34829781 48.85738838 Ta 20.77538150 22.20296332 25.34887301 -42.18767843 16.76716610 30.76760458 Ta 24.22083292 20.78984966 24.28503885 -26.53307040 -41.98596084 -25.27633126 Ta 25.42299150 22.40698366 24.18107110 41.60496947 22.70543635 -23.90177070 Ta 25.32825321 21.13102478 25.59995250 52.67346185 -43.23989886 48.07393470 Ta 24.26120756 22.51193751 25.75226748 -32.93784884 32.76508596 36.13491531 Ta 20.96431997 24.02670191 23.93301809 -21.86992568 -3.68772261 8.48239139 Ta 22.70379337 25.73854596 23.76922180 -25.29375657 29.83498630 41.52841759 Ta 22.28229695 24.02031036 25.68745344 19.68087537 -14.10036862 15.61968321 Ta 21.02015752 25.37970777 25.77711528 -20.30260542 24.69365693 7.64131976 Ta 23.87871118 23.75213077 23.73125112 27.51798411 15.85366090 56.28059300 Ta 25.21824351 25.63616082 23.93518871 28.59161275 14.90558906 -7.10930812 Ta 25.62968218 24.18991652 25.79977655 25.61203840 -5.54460441 9.92886584 Ta 24.18543805 25.45460942 25.57327937 -21.08835138 17.51976341 22.70396666