32 Lattice="52.85962061220877 0.0 0.0 0.0 52.85962061220877 0.0 0.0 0.0 52.85962061220877" Properties=species:S:1:pos:R:3:forces:R:3 energy=-100.87714841844112 stress="4.613362484950804e-05 -4.9165947160675575e-05 -5.843036785901983e-05 -4.9165947160675575e-05 -0.000165626487676375 0.00014306943312015282 -5.843036785901983e-05 0.00014306943312015282 -0.00011156730869060355" free_energy=-100.87714841844112 pbc="F F F" O 26.50828515 26.49123964 26.61071700 0.32291044 -1.06080972 0.40432514 Ag 28.36730259 28.23088469 26.42572060 2.48303156 1.13466841 -1.52283663 Ag 28.34348204 26.58852531 28.14110312 1.72670743 -1.01610007 4.58037189 Ag 26.43049329 28.18759024 28.65661666 -5.17025317 1.18576152 -3.20932711 O 30.21423232 26.64216245 26.38800162 0.13576813 0.07004787 0.50618791 O 32.18916614 28.10581436 26.41674718 0.48994716 0.14412704 1.76992811 Ag 32.01062143 26.47066243 28.45916092 -1.83295362 1.09924016 -2.07773128 O 30.17572835 28.47944568 28.44281713 -2.95675567 5.45994571 0.82434357 O 26.54106531 30.32732238 26.62526085 3.20860103 2.47076428 4.30332769 Ta 28.34665714 32.22642384 26.27402289 1.64425163 0.75827503 1.67735861 Ta 28.18825449 30.17274856 28.31705668 1.24866296 -13.96110700 -13.36905347 Ta 26.62945008 31.86465363 28.24247051 -1.42904452 4.19486470 -6.62468818 O 30.32557204 30.18497761 26.60400153 -7.90353483 1.74515688 6.21334353 O 31.95918929 32.01764098 26.50636067 1.61952635 -1.50392670 1.77435441 Ag 32.12711506 29.98397395 28.26907921 -1.42295597 6.33107234 -4.74336532 O 30.36310442 32.21092089 28.18444388 3.45128593 4.98876920 -2.92688474 Ag 26.45040049 26.32494466 30.10851306 -1.73725464 0.12423885 1.34513566 Ta 28.26204717 28.42968391 30.26147971 6.34210904 -6.19119267 -1.97766863 Ag 28.26869626 26.61710263 31.90940885 5.82637696 -2.28938199 1.07711239 Ta 26.65934481 28.11067621 32.19547979 -6.80908236 1.41333015 2.35726768 Ta 30.33441608 26.40368115 30.42339420 -0.53034357 -4.43703272 -1.87896703 Ag 32.09948201 28.47976089 29.98545506 2.87644748 -3.92965323 6.87903310 Ta 32.24215978 26.38147633 32.07302243 -1.94422769 4.33476019 0.83168940 O 30.01233625 28.25968078 32.16975559 4.28340720 -0.18166837 -2.32444539 Ag 26.61508211 30.18822330 29.97339080 0.31479524 -0.00886301 -3.61659450 Ta 28.48212507 31.83222495 30.32096521 -3.25988704 0.69506429 1.72939152 Ta 28.31736644 30.43733206 31.91716508 -3.70640402 1.61637146 13.40518645 O 26.57665368 32.20347038 31.87095096 6.88080652 1.78544838 1.96318775 Ag 30.39158217 30.10290928 30.30316362 -4.31458580 0.44931035 -4.13487827 Ag 32.07428129 32.21648768 30.16377781 -0.82813771 -3.24173090 0.93263976 Ta 32.01577227 30.05020082 32.17320090 2.88868696 -1.45080004 -2.33425890 O 30.01371608 32.20364564 31.76177534 -1.89790140 -0.72895037 -1.83348509