32 Lattice="59.747773361206086 0.0 0.0 0.0 59.747773361206086 0.0 0.0 0.0 59.747773361206086" Properties=species:S:1:pos:R:3:forces:R:3 energy=-312.50508570254715 stress="8.231739137529183e-05 2.1893438137116636e-05 -5.6390694286502515e-06 2.1893438137116636e-05 7.530256689427316e-05 -2.5977014903241007e-05 -5.6390694286502515e-06 -2.5977014903241007e-05 8.14431852157184e-05" free_energy=-312.50508570254715 pbc="F F F" Ta 29.75339093 29.96651568 29.96592764 1.12054590 0.60196897 0.63050684 Ta 32.18240381 31.85059782 29.73916599 -1.67600183 1.38584201 1.71813314 Ta 31.85939218 29.73646815 32.12474753 -0.18017147 1.63950070 -0.24811304 Ta 29.68899319 32.04505090 31.86468949 1.88854235 0.02943751 0.33184996 Ta 33.80832690 29.83967684 30.04271494 1.61021749 -0.07128030 0.82434239 Ta 36.32963490 31.73474723 29.76180511 -1.58721708 0.29116909 1.16853051 Ta 36.02031851 30.05952905 32.16260553 0.38016616 -1.78635539 -2.88233735 Ta 34.29460820 32.17091840 32.13011081 -1.70454858 -2.16616429 -0.79489519 Ta 30.09854839 34.28847005 29.75224067 0.56567791 -1.78175208 0.51254695 Ta 32.18270524 36.06515754 29.75287588 -0.29204747 -0.03174456 0.56190878 Ta 32.03980503 34.10637360 32.18879393 -0.79858470 -0.65951856 -2.46351999 Ta 29.83879782 36.18231451 31.62717385 1.01775243 -0.24270036 0.60400350 Ta 34.30140660 34.29071410 30.11672727 -1.20324470 -1.66346298 -2.75545029 Ta 36.37089515 36.20329856 29.99809243 -0.38633199 0.00110915 0.43483148 Ta 36.09286071 34.22999556 31.97943571 3.34989606 -0.71074705 0.80040717 Ta 33.97990165 36.12674714 32.01908238 0.42819175 2.37879702 0.22149260 Ta 29.75054256 29.85361619 34.19433417 0.36616359 0.68042986 -0.60660198 Ta 31.84008657 31.82312621 34.13701335 0.18884086 0.30615994 0.51391946 Ta 31.87545923 29.74172585 36.12266830 0.51076896 0.70049332 -0.63543838 Ta 29.80710664 31.79437362 36.35104971 1.15565746 0.31483036 -0.95992628 Ta 34.36841780 29.81873106 34.25102577 -1.43444296 1.09357507 1.03527413 Ta 36.49192273 31.77934000 33.96245756 -0.23781405 2.20096879 2.34237951 Ta 36.42848147 30.04295937 36.34496158 -0.73728056 0.66154781 -0.66715146 Ta 34.02009259 31.75319482 36.45955459 -0.00676471 0.31182430 -1.55594839 Ta 30.05192815 34.29317084 33.92646280 -1.62697429 -0.40185735 0.34103056 Ta 32.18456284 36.21281195 34.24984032 -0.94362709 2.02230865 -0.85076667 Ta 31.82623948 34.37723642 36.08004182 1.17431309 -3.50429468 0.93339127 Ta 29.98524384 36.13129167 36.33405407 -0.80533179 0.74657251 -0.33594582 Ta 34.18202205 34.18719727 34.07126035 0.66062674 -0.80045158 2.72165900 Ta 36.38928061 36.19610077 33.95662370 -1.05330034 -0.72899581 0.53145945 Ta 36.10595510 34.23360042 36.31645757 -0.63857944 -0.69670249 -1.16880318 Ta 34.00436348 36.06834906 36.34719723 0.89490230 -0.12050757 -0.30276870