108 Lattice="12.65539488056776 0.0 0.0 0.0 12.65539488056776 0.0 0.0 0.0 12.65539488056776" Properties=species:S:1:pos:R:3:forces:R:3 energy=-184.13030196595636 stress="-0.6144416823950261 -0.4145709078610187 0.19614520090794585 -0.4145709078610187 0.27719855986168085 0.4969552385535536 0.19614520090794585 0.4969552385535536 0.18494867493269296" pbc="F F F" Al 0.03383508 0.02788883 -0.01226304 -0.24018859 -0.20662310 -0.20887917 Al 2.07451527 2.12944121 -0.03421430 0.44668209 0.32391560 -0.24723366 Al 2.09524023 -0.03227471 2.08172170 0.34268204 -0.30975430 0.40843364 Al 0.02049860 2.06745616 2.14039102 -0.36902488 0.52054424 0.17711501 Al 4.16676652 -0.03037150 -0.01254417 0.11135745 -0.12760501 -0.21574941 Al 6.29202065 2.12638234 -0.02360218 0.05053584 0.17998701 -0.27739857 Al 6.29125311 0.01918792 2.12122239 0.15836853 -0.30369682 0.24126495 Al 4.21116569 2.08248826 2.11284581 -0.07403410 0.70246178 0.27472277 Al 8.41300782 -0.03864464 -0.02205631 -0.31411755 -0.18297400 -0.19727621 Al 10.54805698 2.07862741 -0.00129066 0.24516171 0.29901579 -0.36246535 Al 10.51425726 0.01739196 2.11002905 0.30329576 -0.36791243 0.22600498 Al 8.44320803 2.11824797 2.06843169 -0.59036260 0.30688620 0.68921475 Al -0.03373038 4.21894189 -0.00782260 -0.11353750 -0.00246423 -0.14793848 Al 2.13957259 6.35034538 -0.03902087 0.18243963 -0.26647515 -0.18441606 Al 2.11004418 4.18660546 2.14453603 0.42425390 0.13588880 0.17871362 Al -0.00120497 6.27832753 2.08730144 -0.25937107 0.01761548 0.32217939 Al 4.19523748 4.19716793 -0.00991745 0.02477904 0.12460557 -0.16798682 Al 6.33556056 6.33374451 -0.04008601 -0.13944765 -0.03664631 -0.14708362 Al 6.32139662 4.21233429 2.06783767 -0.10180607 0.09025278 0.62133606 Al 4.21083899 6.28584288 2.11570278 0.10767918 0.16632378 0.29515664 Al 8.43862925 4.24520824 0.02684294 -0.30524987 -0.01761148 -0.42391273 Al 10.56633757 6.34421263 -0.02187142 0.19312271 -0.03297845 -0.12283420 Al 10.52873728 4.19156845 2.09723029 0.34880308 0.16495854 0.44138794 Al 8.43736336 6.35104883 2.10017753 -0.49454830 -0.22594894 0.44466230 Al -0.01557563 8.42428586 0.00247633 -0.31822302 -0.26023145 -0.24226175 Al 2.07370299 10.53795511 0.00509005 0.32298472 0.27648525 -0.36218522 Al 2.07993481 8.41070447 2.08228868 0.61207822 -0.39343077 0.47315029 Al 0.04052816 10.57403496 2.11593473 -0.42786515 0.24459209 0.21262088 Al 4.19701635 8.43345055 -0.01535035 0.20851995 -0.23662860 -0.15073388 Al 6.33349560 10.58728708 0.01120682 -0.06300844 0.12391770 -0.17715712 Al 6.35561403 8.42681710 2.08554362 -0.36627016 -0.39609829 0.51643360 Al 4.18199299 10.58192097 2.09748302 0.17238596 0.13541990 0.38193982 Al 8.45742759 8.45258584 0.03152711 -0.38057371 -0.36626131 -0.58457027 Al 10.55429134 10.56630199 0.03687587 0.22956352 0.14919859 -0.22004345 Al 10.50669111 8.45148815 2.13232164 0.61943936 -0.40734015 0.26567388 Al 8.47776136 10.52404118 2.08432935 -0.60670466 0.56455518 0.45107414 Al -0.01776426 0.01973674 4.20299697 -0.10890179 -0.24279016 0.20236260 Al 2.14664488 2.11265014 4.21937967 0.29593722 0.37947625 0.09471576 Al 2.13654882 0.03598663 6.34896890 0.20166752 -0.41156245 -0.13638839 Al 0.00594404 2.10674260 6.36513207 -0.35624265 0.32969404 -0.14124932 Al 4.18852988 0.03401501 4.17939739 0.08142295 -0.36565514 0.23737622 Al 6.28673125 2.14667088 4.18361184 0.19999394 0.50421093 0.26969553 Al 6.36941091 -0.03158908 6.24789988 -0.18466025 -0.09159679 0.14950779 Al 4.22943863 2.07453947 6.36509230 0.16422037 0.66707638 -0.41539038 Al 8.45340537 -0.03593032 4.23485957 -0.41073578 -0.08011258 -0.14541473 Al 10.57518570 2.06757659 4.23233911 0.12348192 0.61397034 0.05751760 Al 10.56300448 -0.01281669 6.31378418 0.22191134 -0.29146393 0.07369907 Al 8.46380040 2.09490677 6.36878597 -0.62316147 0.44859307 -0.30257710 Al -0.00917179 4.20330977 4.21379259 -0.25196159 -0.02183383 0.00962307 Al 2.09435516 6.34838261 4.18694910 0.56612849 -0.06615869 0.28832922 Al 2.06757755 4.18467440 6.28651027 0.64859284 0.31565581 0.10666832 Al -0.01153029 6.29461622 6.30303488 -0.06756803 0.14346574 0.11034945 Al 4.18356567 4.29005666 4.25747421 0.21362894 -0.33612747 0.09312954 Al 6.30110831 6.26345247 4.21081402 0.11830153 0.26675450 0.13786567 Al 6.36168741 4.19288271 6.36484038 -0.24088796 0.04321296 -0.28003776 Al 4.25049122 6.36017073 6.36512858 -0.20509698 -0.12480492 -0.16278569 Al 8.43936759 4.26054547 4.21933273 -0.45117883 -0.27576011 0.04945913 Al 10.51462880 6.35801572 4.21094377 0.29808880 -0.18672243 0.05878688 Al 10.51553502 4.25226736 6.36889743 0.35766722 -0.07893722 -0.35756366 Al 8.44701191 6.32477752 6.35511392 -0.64601974 0.13164176 -0.34085681 Al 0.00487609 8.40372963 4.19108435 -0.39142993 -0.23952062 0.11171240 Al 2.06958888 10.52300412 4.19125668 0.47205670 0.30745734 0.20700302 Al 2.11088037 8.47147333 6.31503508 0.44978000 -0.76582906 -0.02610832 Al -0.02649258 10.54400060 6.36430402 -0.21693034 0.23433020 -0.21900792 Al 4.23357984 8.45451663 4.19551158 0.07361605 -0.57987327 0.06098555 Al 6.35351361 10.53274104 4.24427418 -0.14462025 0.18765381 -0.15345357 Al 6.34323584 8.40478671 6.36669387 -0.14120338 -0.35640942 -0.25817949 Al 4.21679902 10.55429006 6.32704856 0.07057879 0.16525602 -0.11987058 Al 8.42309393 8.43959065 4.18796463 -0.59997783 -0.52529102 0.34005135 Al 10.50533248 10.58290205 4.21462065 0.24595140 0.21596983 0.10344469 Al 10.51572425 8.44711604 6.30823333 0.26405118 -0.25583863 -0.00437440 Al 8.39996611 10.57652103 6.33368727 -0.20848628 0.22875099 0.01448543 Al -0.01731598 -0.02572412 8.43874987 -0.14888572 -0.18565479 -0.18183088 Al 2.12445777 2.13165886 8.40752343 0.22027160 0.31206595 -0.10548758 Al 2.11823328 0.00849312 10.57453149 0.20742456 -0.17137798 0.11735880 Al -0.02587390 2.13735572 10.54984926 -0.20592403 0.12361472 0.15584067 Al 4.25848861 0.00837401 8.43769182 -0.03099720 -0.37757653 -0.22951297 Al 6.29276108 2.08688104 8.42939111 0.26295753 0.48340090 -0.35985181 Al 6.36253941 0.02389350 10.56122721 -0.09432002 -0.17120479 0.25777153 Al 4.19440845 2.13407591 10.58258801 0.11154600 0.25770211 0.19014045 Al 8.45578348 -0.03526706 8.46344238 -0.39240660 -0.24039200 -0.42608361 Al 10.57227972 2.11142473 8.40361976 0.32445865 0.28719634 -0.15322444 Al 10.57515251 -0.02645346 10.52253884 0.12327860 -0.05640889 0.12944021 Al 8.46693949 2.13735640 10.55510503 -0.37999161 0.17720338 0.17077153 Al -0.03784685 4.26232658 8.46590851 -0.19082511 -0.07185445 -0.43148659 Al 2.14448631 6.28037821 8.47275523 0.23304162 0.13603918 -0.74907459 Al 2.08449629 4.19862253 10.57170743 0.39761861 0.15731059 0.27122844 Al -0.01445606 6.36641431 10.53770552 -0.23809310 -0.06733580 0.24435642 Al 4.18117511 4.19045108 8.39880005 0.23295690 0.19893143 -0.30459907 Al 6.34910585 6.29265133 8.42201654 -0.23422183 0.09392343 -0.28118318 Al 6.33380910 4.19417606 10.52730561 -0.11876727 0.09576823 0.13316863 Al 4.23186408 6.35361372 10.53870009 0.06548639 -0.25876708 0.19192634 Al 8.44698526 4.25391614 8.40376389 -0.52760546 -0.33707109 -0.18248683 Al 10.50528157 6.33622634 8.42546307 0.47044539 0.11048303 -0.18977260 Al 10.51463522 4.19520347 10.56415951 0.36585761 0.08393862 0.14047002 Al 8.45823053 6.28853620 10.52202889 -0.47748901 0.17383299 0.34469504 Al 0.02443718 8.47118705 8.42804411 -0.36055395 -0.60563153 -0.35913975 Al 2.10640188 10.53915114 8.42764220 0.30850369 0.49139219 -0.27196722 Al 2.08417306 8.42001498 10.55228439 0.38113616 -0.31937525 0.39375385 Al 0.01659409 10.52829245 10.56836444 -0.14637871 0.17951036 0.14364708 Al 4.18664887 8.47264945 8.47138273 0.17530999 -0.63412400 -0.62664484 Al 6.30125102 10.55619880 8.44952272 -0.04284179 0.30978077 -0.29514738 Al 6.32390479 8.43113905 10.53068110 0.06624442 -0.31112657 0.27212348 Al 4.16079711 10.53960555 10.55872428 0.11443490 0.24967426 0.28604845 Al 8.42115782 8.47611801 8.42749783 -0.31928929 -0.52276091 -0.30022456 Al 10.57503543 10.56438488 8.44069730 0.22076636 0.20315292 -0.33129283 Al 10.54172761 8.45417778 10.56691350 0.23033365 -0.33945141 0.19373740 Al 8.46631781 10.56192827 10.54355200 -0.36129540 0.27236604 0.24806356