32 Lattice="7.816594282769218 0.0 0.0 0.0 7.816594282769218 0.0 0.0 0.0 7.816594282769218" Properties=species:S:1:pos:R:3:forces:R:3 energy=-200.00360386299616 stress="-0.008102202589064762 9.848459393219264e-05 0.002418095648523681 9.848459393219264e-05 -0.008178311715001727 0.0018688686267504544 0.002418095648523681 0.0018688686267504544 -0.007262327801542815" free_energy=-200.00360386299616 pbc="F F F" Ta 0.01098499 0.01094736 0.02522686 0.27133719 0.19247038 0.27695857 Ta 1.93168047 1.95166524 0.00394678 0.54473667 0.53377168 -0.71714995 Ta 1.94522659 0.00721724 1.95686897 0.60692362 -0.87718285 0.26694411 Ta 0.00731966 1.92067596 1.96092180 -0.85109020 0.74771296 0.38578956 Ta 3.90152993 0.03839098 0.01076987 -0.69528494 -0.21235875 -0.17603309 Ta 5.85827329 1.92614920 0.03095885 0.19352850 0.76298148 -0.18099116 Ta 5.84482508 0.01115816 1.95624006 0.20261193 -0.31142608 0.70931346 Ta 3.91748725 1.92386989 1.98712536 -0.22963551 0.45464415 -0.13212291 Ta 0.02246082 3.93820648 0.03771183 -0.39412476 -0.90032057 -0.25587025 Ta 1.92777663 5.83821242 0.00522449 0.96198123 0.25120601 -0.16892443 Ta 1.92362564 3.91380438 1.94374857 0.65773172 -0.13021473 0.36011892 Ta 0.02726398 5.86272863 1.93337768 -0.27483383 0.36832932 0.79586837 Ta 3.91350300 3.90489429 0.03654134 -0.42893520 -0.35097314 -0.74152526 Ta 5.89973482 5.87500874 0.00718487 -0.45301541 -0.40919843 0.39791617 Ta 5.85057366 3.91622385 1.94041869 0.80553809 -0.42680023 0.61564436 Ta 3.94451390 5.89829960 1.99179367 -0.73102986 0.55043486 0.30902525 Ta 0.04151017 0.02989027 3.87953873 -0.21959504 -0.42583016 -0.39139719 Ta 1.95970336 1.94191158 3.91643522 0.04613932 0.40454599 -0.08857772 Ta 1.99211934 0.01843379 5.87307348 0.59612553 -0.06712637 0.15736515 Ta 0.02037017 1.93508005 5.82947947 -0.16869544 0.76573569 0.16868047 Ta 3.89125336 0.03497525 3.91027585 -0.28863485 -0.96051874 -0.28276855 Ta 5.87423502 1.93576749 3.91936843 0.93498547 0.54498032 -0.59121938 Ta 5.86560600 0.01677967 5.84257324 -0.43727273 0.27543591 -0.29395877 Ta 3.94634802 2.01000622 5.83841573 -0.54136581 -0.08263369 0.99980898 Ta 0.02095233 3.92526099 3.89447155 -0.82919047 -0.54521201 -0.26098174 Ta 1.92406858 5.85708534 3.94592191 0.70356607 0.70870889 -0.58177027 Ta 1.99139387 3.90502843 5.88272849 0.12167534 -0.43264768 0.73547281 Ta 0.02039577 5.85205116 5.89223871 0.31677172 -0.42537512 -0.27869805 Ta 3.93609952 3.88311883 3.94642851 -0.40761084 0.24422263 -0.78960414 Ta 5.85877101 5.85981253 3.94435181 0.29115891 0.15395991 -0.79080649 Ta 5.83676223 3.92414157 5.84547216 0.48744130 -0.66588918 0.35173528 Ta 3.92971854 5.84123671 5.84861709 -0.79193773 0.26456755 0.19175787