108 Lattice="11.251436183528263 0.0 0.0 0.0 11.251436183528263 0.0 0.0 0.0 11.251436183528263" Properties=species:S:1:pos:R:3:forces:R:3 energy=-526.550642987048 stress="-0.011335909116765934 -0.002347693541964142 -0.002832699830068981 -0.002347693541964142 -0.01205906468871955 0.0023567897081881654 -0.002832699830068981 0.0023567897081881654 -0.005659146080196218" pbc="F F F" Ta 0.00466120 0.02494485 0.00618900 1.77738614 1.16119920 1.85596081 Cu 1.92578927 1.91572904 0.00183458 -0.01664831 -0.18815557 -0.71497646 Cu 1.84047208 0.02576690 1.87594108 0.46333030 -0.32454579 0.11221956 Ta 0.03574572 1.87732332 1.82756424 -0.85589517 -0.92094247 0.41488907 Ta 3.74060679 0.01160680 0.03295920 -0.93543986 0.79504954 0.75529129 Cu 5.58276264 1.87504476 0.00653491 0.35670873 0.25314102 -0.37636113 Cu 5.60466399 0.01043627 1.85510898 0.62870722 -0.44176328 -0.03201577 Ta 3.79992040 1.84232128 1.89958335 -0.74098755 0.45803811 -0.16833678 Cu 7.49621244 0.03369441 0.02773949 -0.42064131 0.40504926 0.94648001 Cu 9.37758890 1.85197477 0.02590626 -0.22859055 0.00183742 0.60062747 Ta 9.34610749 0.01603912 1.87274533 -0.87591128 1.11934659 1.09674884 Cu 7.49066751 1.88874552 1.89661018 -0.81068839 -0.20164562 -0.64353270 Cu 0.01951501 3.78231055 0.04784108 -0.56516700 -0.46442341 -0.35505032 Ta 1.88821313 5.59224918 0.00109443 0.39617227 0.96777249 -1.34703766 Ta 1.84313130 3.75854568 1.87339917 0.91165582 -0.31061789 1.06973859 Cu 0.01304380 5.60114100 1.87363397 -0.41834849 0.47051610 0.24932746 Cu 3.72408250 3.74223311 0.02439746 0.39656906 -0.79511900 -0.66561286 Ta 5.60622148 5.56555896 0.03091149 0.24654615 0.17724325 -0.25839925 Cu 5.66152328 3.69145134 1.83160753 0.08330065 0.30734675 0.18661494 Ta 3.72664961 5.61016113 1.88996035 0.72138775 -1.17291480 -0.48422681 Cu 7.53581518 3.70942361 0.01543502 -0.25546423 0.10753928 -0.01934764 Cu 9.34991826 5.67012221 0.03269073 -0.78564877 0.21232694 0.48593716 Ta 9.32174431 3.72926565 1.84695560 0.47539549 0.00521313 -0.10156239 Cu 7.48256041 5.65738967 1.91237101 0.21559470 -0.54520263 -0.90258629 Cu 0.01201741 7.49534054 0.05075339 -0.27196049 -0.01796713 -0.23411057 Ta 1.89401268 9.38629508 0.00732586 -0.15604150 -0.51653296 0.61276511 Ta 1.90073066 7.52406947 1.89471263 -1.52288142 -0.30671679 -0.12393949 Ta 0.01932766 9.40548285 1.86761911 1.38859147 -0.38675829 0.72030591 Cu 3.72994198 7.47437375 0.01606547 0.44469778 0.27560497 -0.65227465 Cu 5.69417519 9.39397358 0.00244427 -0.06110329 -0.60486972 0.35485420 Ta 5.63376080 7.47272005 1.90532581 0.58208452 1.13923579 -1.73125149 Ta 3.75179606 9.37819085 1.89397184 -0.05539544 1.46093119 -0.37651480 Cu 7.50054638 7.51759583 0.00815915 0.29618873 -0.03058370 -0.02601339 Ta 9.34674338 9.38999496 0.02482040 -0.91984935 -1.16600586 0.89329529 Cu 9.37840278 7.51525648 1.84822416 0.03592056 -0.18667758 -0.30829509 Cu 7.56982347 9.37302156 1.86921137 -0.31182224 0.42168254 0.20470138 Ta 0.01773928 0.01454965 3.78662847 -0.08384519 0.40856001 -0.90676837 Cu 1.91247759 1.86963579 3.73233304 0.42231480 0.05459753 0.23413287 Ta 1.88563236 0.00422675 5.63084996 1.16993353 -1.47582043 -0.45128976 Ta 0.03078903 1.84709571 5.65715977 -2.80307300 0.38613969 -1.50455073 Cu 3.73568790 0.01611492 3.75772307 0.32144106 -0.33323504 -0.36658321 Cu 5.65769072 1.89343002 3.74576504 -0.06273611 0.35378321 0.54619778 Cu 5.62378603 0.03625105 5.65008015 -0.14963736 -0.38529452 0.14459510 Cu 3.75595130 1.88471757 5.60934390 0.17993603 0.03658753 -0.67940200 Ta 7.46390967 0.03589885 3.73649647 0.48434273 -0.31727202 -0.11778224 Ta 9.39375821 1.90031772 3.71298068 0.72513882 -0.30076559 0.58511479 Ta 9.41030340 0.00907886 5.62229683 -0.56609624 0.43086461 -0.75868858 Cu 7.50950148 1.84514198 5.61980562 -0.31254329 0.32825566 -0.10502451 Ta 0.01346443 3.76620620 3.79433961 -1.36644888 -0.42893511 -0.43151171 Cu 1.91875077 5.65040608 3.71871245 -0.34245491 -0.50802439 0.59221507 Ta 1.84635966 3.72272430 5.63470772 2.25758616 0.96464482 -1.40012572 Cu 0.00464035 5.60021643 5.63809307 -0.83853127 0.69058228 -0.28680775 Cu 3.81778149 3.78535694 3.75868118 -0.25024439 -0.42564166 0.21250305 Ta 5.61561230 5.64370494 3.77514428 0.56402388 -1.28393758 0.61645984 Cu 5.59339628 3.76232458 5.63723559 -0.32051080 -0.51171230 0.22784761 Cu 3.74219893 5.66241048 5.60278034 0.06311723 -0.50739922 -0.17225346 Ta 7.46741564 3.78115281 3.75060666 0.17153355 -0.49147795 0.38624174 Cu 9.35511842 5.66230458 3.73415511 0.39648020 -0.53664109 -0.06363592 Cu 9.38264843 3.80569417 5.61459137 0.47410705 -0.29325965 -0.10972917 Cu 7.48303002 5.58870005 5.65956244 0.32954795 0.48997774 -0.24789327 Cu 0.01015219 7.53395641 3.77961497 -0.36911616 -0.43761213 -0.23210140 Cu 1.90075233 9.38879987 3.70510346 -0.70375660 0.86424705 0.30540631 Ta 1.86338193 7.48525320 5.60592941 -1.22456133 0.59377217 -0.55883693 Ta 0.00420310 9.34320874 5.65986059 1.19567544 -0.50269295 -0.66536871 Ta 3.75864040 7.48870863 3.76997564 0.39129373 0.43402483 1.16620985 Cu 5.61814367 9.38753328 3.76767581 0.59478774 0.28471795 0.18399799 Cu 5.66126193 7.49715103 5.64587053 -0.24232543 -0.03522369 -0.49333081 Ta 3.76466411 9.37642056 5.61511486 -0.55460098 1.53391680 -0.36723312 Ta 7.53569395 7.46961693 3.72296203 0.11200173 0.27643682 0.97897982 Cu 9.37045816 9.37241072 3.77486655 -0.02957188 -0.15596150 -0.18390717 Cu 9.37056424 7.50021289 5.64993915 0.71156076 -0.42771360 0.07033358 Ta 7.52607166 9.35467264 5.64077404 -0.43043993 1.13258835 -0.34425715 Ta 0.01504329 0.03409162 7.50692540 -1.13361437 -1.56572620 -0.06535544 Ta 1.85639805 1.85014552 7.47816676 3.12542756 0.67676267 1.00258638 Ta 1.86964206 0.04479987 9.41019264 1.15605356 0.11048136 -0.24912117 Ta 0.01714205 1.91425004 9.37127877 -1.12933243 -0.34002244 1.06801908 Cu 3.73042663 0.00973899 7.51681664 0.08370681 -0.69092066 -0.13111468 Ta 5.63158447 1.85279589 7.50254797 -0.24793867 0.08145710 -0.32390798 Ta 5.58617614 0.00070982 9.34979166 -0.25085774 1.21435678 -0.64476915 Cu 3.77142105 1.85005604 9.34772954 -0.23286742 0.64011702 0.61585216 Cu 7.52173333 0.03614724 7.51157568 -0.08889641 -0.39710043 -0.19979253 Ta 9.35886214 1.90084789 7.49190825 0.90755425 -0.62558374 -0.32274843 Cu 9.40302598 0.00810673 9.34555998 -0.85697047 1.17931932 -1.13117320 Cu 7.50328409 1.88609211 9.34777807 0.07343071 -0.87385521 0.98810318 Ta 0.00109374 3.77673340 7.52653083 -2.53537508 0.34517361 -0.84876970 Ta 1.90521996 5.65782111 7.45264583 -0.41399552 -0.43276232 0.19731586 Ta 1.83826011 3.77651673 9.38533183 1.38268032 -0.86010173 1.42145526 Cu 0.03661878 5.61656374 9.35255795 -0.18817806 0.31324664 0.52040374 Cu 3.73253033 3.75021216 7.46032833 0.37250254 -0.16254592 -0.16938218 Ta 5.57945108 5.64398672 7.46393900 0.42497911 -1.33059747 -1.19455599 Ta 5.69796060 3.77456200 9.35719291 -0.47710260 -0.78690892 1.47174521 Ta 3.70961623 5.59166414 9.34718559 0.27363852 0.02282358 2.39383263 Ta 7.54604939 3.72284990 7.52005831 -0.16343989 0.97300392 -1.38354418 Cu 9.37186117 5.62654437 7.50453581 0.41493719 -0.14822374 -0.09940595 Ta 9.36041374 3.72603139 9.38635159 -0.58608018 0.43642434 -0.29133682 Cu 7.49491327 5.66525356 9.37061196 -0.04768468 -0.27197350 0.81452078 Cu 0.00317396 7.47391104 7.52255117 -0.30643183 0.22824878 0.17427084 Cu 1.83953965 9.40171913 7.46561385 0.07115584 0.10507433 0.56907082 Cu 1.86434810 7.52324252 9.38022788 -0.15454228 0.13596566 0.19238526 Cu 0.01936826 9.41253645 9.40154490 0.56179090 -0.60309721 -1.24079767 Ta 3.76336526 7.49120003 7.51500167 -0.61552399 1.34933046 -0.84130560 Ta 5.62916724 9.40383138 7.50549662 0.30271516 1.58600227 -0.22906157 Ta 5.60874748 7.52746431 9.39104541 0.55475561 -0.69552892 2.47416022 Cu 3.74473958 9.36272560 9.40573073 -0.07574303 0.05820607 -0.16978536 Ta 7.49732369 7.47307679 7.53454038 0.38000234 -0.80631708 -1.46271298 Ta 9.36402434 9.36729252 7.53846841 0.20402944 0.13305602 -0.35334334 Ta 9.31374492 7.47905565 9.39976890 0.30988067 -0.76770534 0.24046969 Ta 7.53258394 9.38636623 9.40386533 -0.22074726 0.70721324 0.36632755