256 Lattice="16.40371067598513 0.0 0.0 0.0 16.40371067598513 0.0 0.0 0.0 16.40371067598513" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1849.1277219931019 stress="0.0007414608231410179 9.336860294653042e-05 -0.00019672910982173122 9.336860294653042e-05 0.0003892616298746259 -4.7036180450052295e-05 -0.00019672910982173122 -4.7036180450052295e-05 0.0009271377659079455" free_energy=-1849.1277219931019 pbc="F F F" Ta 0.02150898 0.02636380 0.00246165 0.63594607 0.56423439 0.45911410 Ta 2.03893661 2.07272818 0.03635808 0.18864243 -0.34606472 -0.68886999 Ta 2.03903609 0.01460735 2.01324860 0.26763095 -0.25894283 0.50315084 Ta 0.01177913 2.00539999 2.01791602 -0.39675495 0.39986558 0.47365180 Ta 4.13279757 0.03056254 0.03763796 -0.36764231 0.38806376 0.13392303 Ta 6.15689993 2.04020598 0.02097362 -0.08709672 0.30768497 -0.26019285 Ta 6.11561961 0.01284274 2.04759616 0.72720403 -0.34132560 0.33029871 Ta 4.06648277 2.06128500 2.05765554 0.23057932 0.11408538 -0.01096395 Ta 8.17401845 0.03587146 0.00121392 0.21090843 0.39952959 0.85054673 Ta 10.23109860 2.02860890 0.00976195 0.37552177 0.29962358 -0.28551560 Ta 10.28156125 0.00855308 2.05751281 -0.61902323 -0.28797177 -0.12559123 Ta 8.19897170 2.07982646 2.09569425 0.21702894 -0.56592587 -0.38070523 Ta 12.29219483 0.00711087 0.01782627 0.27966579 0.46266169 0.66373624 Ta 14.34386866 2.03091886 0.00019987 -0.85195554 0.27563324 0.81715147 Ta 14.38614584 0.02489007 2.06621994 -0.86600540 0.49869995 -0.08614424 Ta 12.29697298 1.98397372 2.08253306 0.30084466 0.50949391 -0.79477531 Ta 0.01895406 4.09975811 0.00502445 0.46537894 0.35537723 0.57207163 Ta 2.08214875 6.18437458 0.00614446 -0.57175041 -0.30786288 -0.26138698 Ta 2.01625247 4.06737859 2.03350788 0.04070473 0.50174764 0.14780330 Ta 0.01048097 6.18074932 2.07504383 -0.40117961 -0.30810387 -0.39509729 Ta 4.08946917 4.09148379 0.00769464 0.06604784 -0.06922890 -0.45934537 Ta 6.12820171 6.12607454 0.01643149 0.39607540 0.13761556 -0.72994405 Ta 6.17870426 4.13474695 2.05046404 -0.33019024 -0.32979686 -0.18695877 Ta 4.13779836 6.13993165 2.01315748 -0.41806829 -0.13369741 0.24556411 Ta 8.19540044 4.06433837 0.02107424 0.22216841 0.25646000 -0.53709127 Ta 10.29274655 6.14694497 0.03575121 -0.46066923 0.14924136 -0.48812779 Ta 10.28389348 4.11026666 2.03852897 -0.15215787 -0.20433636 0.03401563 Ta 8.17090074 6.11153299 2.03930461 0.45140822 0.52207708 0.12037395 Ta 12.31476620 4.14148779 0.02374865 0.26568017 -0.69682137 -0.16681553 Ta 14.37981189 6.19682822 0.02015127 -0.93102730 -0.32465543 0.97189993 Ta 14.33718198 4.06846420 2.07983875 0.26948501 0.48544226 -0.46669953 Ta 12.28477781 6.12748334 2.08420025 0.59380288 0.28635542 -0.38387639 Ta 0.00590356 8.24136999 0.00364177 0.44758235 -0.35745900 0.45553644 Ta 2.05071341 10.26138361 0.01903341 0.19663212 -0.30445904 -0.36567744 Ta 2.03905441 8.15862018 2.03123402 0.36902914 0.36392852 0.09068566 Ta 0.02318158 10.22646382 2.05635362 -0.46184874 0.55712457 -0.07949907 Ta 4.14144917 8.17724811 0.00319268 -0.22847460 0.51649450 -0.44935810 Ta 6.17015349 10.25922029 0.01189481 -0.32035150 -0.18849563 -0.31881848 Ta 6.10666015 8.16038970 2.08410440 0.30078898 0.10779718 -0.32700858 Ta 4.11067529 10.24975242 2.06983307 -0.12607897 0.14847319 -0.05729099 Ta 8.22022233 8.21662597 0.03751966 -0.29539313 -0.46874846 -0.48031594 Ta 10.28581907 10.21270769 0.03066080 -0.42332621 0.34695562 -0.63834641 Ta 10.24669729 8.21218662 2.09155154 -0.15720929 -0.29285823 -0.06701184 Ta 8.18283542 10.21443014 2.01610471 0.15930626 0.41288428 0.41979330 Ta 12.29336463 8.22707047 0.04209077 0.50107167 -0.47217780 -0.27019457 Ta 14.35332978 10.24980929 0.02026761 -0.54384907 -0.20065458 0.90438148 Ta 14.37312867 8.16190703 2.11327929 0.17804044 0.43747920 -0.58037789 Ta 12.29602991 10.20391991 2.04137871 0.58770538 0.30307043 0.35177942 Ta 0.01377729 12.31597660 0.00386810 0.42244087 -0.12592183 0.65227389 Ta 2.02619604 14.38532871 0.03261245 0.28684765 -0.63610025 0.26093250 Ta 1.99819391 12.32786214 1.99830135 0.36049934 -0.05630113 0.47780904 Ta 0.02673051 14.36694549 2.07421622 0.23610406 -0.48103955 -0.15647195 Ta 4.08783937 12.29768573 0.02057221 0.02228127 0.27603413 -0.41182804 Ta 6.11113737 14.39047422 0.01987771 0.46405574 -0.72083424 0.50228530 Ta 6.17757522 12.36098169 2.01176064 -0.16978092 -0.11729780 0.44041246 Ta 4.07381417 14.34851925 2.02920810 0.01372212 0.35003409 0.54578862 Ta 8.18259942 12.28705042 0.02669659 0.21109973 0.28749353 -0.56473079 Ta 10.26451437 14.32673353 0.01134199 -0.03272171 -0.32528091 0.25412163 Ta 10.27125719 12.31437480 2.02833665 -0.33329579 -0.33456530 0.26610179 Ta 8.25042545 14.32129479 2.04608273 -0.48107622 0.57161299 -0.01663440 Ta 12.27133016 12.27438863 0.06089353 1.39237899 0.94032772 -0.28739868 Ta 14.37896516 14.38914180 0.00660464 -2.35521543 -2.02752431 1.98849517 Ta 14.37592453 12.31990131 2.07701080 -0.27787052 0.13993700 -0.55422566 Ta 12.26296660 14.36750026 2.09102752 1.22087915 0.22067635 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0.32764457 Ta 14.33443009 0.01025845 6.13223686 -0.51589440 0.38895835 0.03460592 Ta 12.26942397 2.00949181 6.19151863 0.72046627 0.44246685 -0.52711759 Ta 0.02321631 4.05637413 4.13311872 -0.73609897 0.31137713 -0.44446782 Ta 2.02484517 6.15925551 4.07745107 0.04193312 -0.02771083 0.10996306 Ta 2.00911601 4.08745775 6.12390701 0.38304354 -0.02200375 0.13595926 Ta 0.00224670 6.18551717 6.16657688 -0.32095678 -0.03611078 -0.26451827 Ta 4.13555024 4.16289769 4.09701156 -0.30208053 -0.46840683 0.02966121 Ta 6.14238485 6.14845867 4.11313036 0.10265679 0.04723185 -0.00929363 Ta 6.12777589 4.11843323 6.14367738 0.52960608 -0.44026050 0.24561205 Ta 4.11005629 6.09500706 6.14013067 -0.26709361 0.30461044 0.13306911 Ta 8.16765513 4.13074915 4.05051003 0.31523459 -0.30655866 0.37168383 Ta 10.28985257 6.15141978 4.13496849 -0.44716569 0.02703357 -0.14902849 Ta 10.21847449 4.11493255 6.12722596 0.06140391 -0.03703997 0.22033704 Ta 8.16263348 6.16592501 6.15157529 0.01155048 -0.22672284 0.06895046 Ta 12.26448525 4.04834102 4.07946498 0.47494903 0.26819778 0.19324912 Ta 14.33168836 6.17021437 4.13533485 0.39027604 -0.35366296 -0.30367690 Ta 14.36021064 4.11792248 6.07292220 -0.07960113 -0.33290291 0.84095994 Ta 12.33202285 6.16372050 6.15630949 -0.08232880 -0.25508595 0.21350610 Ta 0.00750495 8.26155220 4.07714405 -0.39217322 -0.39669911 0.34084350 Ta 2.01326784 10.27839518 4.11388599 0.41724722 -0.12633094 -0.33200239 Ta 2.09141553 8.21828066 6.17266493 -0.55163527 -0.31123192 -0.20326979 Ta 0.00993417 10.23850111 6.13293824 -0.33530326 -0.18426929 0.38498590 Ta 4.13820421 8.17166624 4.12539909 -0.46439247 0.16925224 -0.19416067 Ta 6.19178896 10.25876938 4.10063328 -0.41465408 0.36717180 0.02264904 Ta 6.11875600 8.20125499 6.12187543 0.07041894 -0.01121538 0.16342183 Ta 4.03935236 10.22189668 6.18573177 0.50440897 0.64540206 -0.51157561 Ta 8.17100647 8.24037744 4.13605375 0.17938229 -0.51959027 -0.40252793 Ta 10.24756115 10.23818184 4.15146908 -0.04724124 0.12297259 -0.42684461 Ta 10.21687428 8.18817785 6.16492637 0.21550952 -0.00700748 0.08652750 Ta 8.20308025 10.21841076 6.12666312 0.13650526 0.23275700 0.32337712 Ta 12.28136755 8.18032361 4.09507009 0.14190001 0.20864080 0.06535662 Ta 14.35897841 10.23038453 4.14047890 0.06780033 0.44878468 -0.34122610 Ta 14.32715303 8.23348401 6.12452405 0.64984172 -0.28452374 0.57652634 Ta 12.27402863 10.21453804 6.16874822 0.39377842 0.39929840 -0.07028845 Ta 0.02401146 12.34224194 4.12388680 -0.68751627 -0.44831073 -0.20832042 Ta 2.01122760 14.32865637 4.12369588 0.50399631 0.59337382 -0.05421351 Ta 2.01265677 12.33044113 6.14343406 0.28789624 -0.17101107 0.41945014 Ta 0.00776992 14.34172120 6.20325554 0.19502980 -0.14696559 -0.06519566 Ta 4.09767771 12.34804398 4.12332703 -0.04065972 -0.29546481 -0.31155750 Ta 6.16568221 14.35572532 4.14034995 -0.09181840 0.37914567 -0.63925994 Ta 6.15908183 12.32293202 6.15998223 -0.03070742 -0.43130676 -0.04085864 Ta 4.11307448 14.33476103 6.18605124 -0.42987144 0.59085714 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