500 Lattice="20.021603308561584 0.0 0.0 0.0 20.021603308561584 0.0 0.0 0.0 20.021603308561584" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2007.7593567286199 stress="-0.005866921450529125 9.379607236734819e-05 -0.0001639466062702998 9.379607236734819e-05 -0.0050027702635742615 0.00017955972350084358 -0.0001639466062702998 0.00017955972350084358 -0.004905934073037952" pbc="F F F" Al 0.01082573 0.02863693 0.03932639 0.40471993 0.30941294 0.27874668 Ti 1.97290992 2.02151793 0.01348195 0.24214214 -0.03626132 0.01332228 Al 1.98032433 0.00327881 2.03828651 0.21158798 0.11582790 -0.13455998 Al 0.03591877 2.00287716 2.03036006 -0.21841702 0.23704951 -0.21526068 Ti 4.01827852 0.00192774 0.00574882 -0.30085835 0.22743625 0.10417557 Ti 6.02780840 2.02055116 0.02802795 0.00004802 -0.28906654 -0.43318654 Al 5.96910251 0.02434738 2.04002664 0.81658119 -0.29232359 -0.18698957 Ti 4.02322977 1.96816677 2.01555545 -0.76240583 0.41131480 -0.19035408 Al 8.02579906 0.00774978 0.01135480 -0.24065332 0.45993664 0.41779912 Ti 9.99243131 2.02495274 0.02518608 0.16927898 -0.11710318 -0.54850587 Ti 10.02044131 0.02149219 1.96632644 0.04702728 -0.40424750 0.36159931 Ti 8.02188459 2.03472441 2.00464700 -0.16817293 -0.40820543 0.20297116 Al 12.00830061 0.01489973 0.02491213 0.19459134 0.56380427 0.17662460 Ti 14.05352066 2.04079648 0.02742459 -0.23953097 -0.39899541 -0.70091418 Ti 14.04246726 0.02227155 1.99103701 -0.34157519 -0.35402915 0.09310624 Ti 11.98710062 2.03994612 2.02803905 0.27473765 -0.48046143 -0.11851192 Al 16.04424136 0.01755971 0.00233741 -0.25839233 0.33429989 0.18194130 Al 17.99006839 2.03027585 0.03666717 -0.25297858 0.17335774 0.27892331 Ti 18.04994274 0.02990045 1.96635720 -0.34801655 0.38466900 0.53285599 Ti 15.98085215 1.98248611 1.97348410 0.87086832 0.35301801 0.27094201 Al 0.03983161 4.05484552 0.00019774 0.28836913 -0.20357777 0.40348098 Al 1.96419610 6.02223625 0.03967665 0.48174779 -0.11239689 -0.14284248 Ti 2.00037581 4.03528089 2.02927884 0.11656333 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0.00011858 -0.19925928 Al 17.99741337 5.97402144 0.00106564 -0.15474136 0.29825060 0.39046243 Al 18.05578789 4.01325203 2.02405410 -0.34506491 -0.23550299 0.14216272 Ti 15.98340038 6.02003859 1.97227431 0.33744411 -0.66967771 0.28959502 Al 0.01540057 7.98236431 0.01484128 0.30578094 0.18402754 0.53417236 Al 1.99210589 10.03971786 0.02954226 0.33753274 -0.65351074 -0.29830968 Al 1.98032875 7.99970984 1.97253389 0.35701734 0.14827877 0.33472658 Ti 0.00766412 10.01927809 2.00443732 -0.34236938 -0.20571536 0.15457852 Ti 4.01274788 8.01902795 0.02305284 -0.24605227 0.19525787 -0.33047614 Ti 5.95868658 10.04370574 0.02133599 0.21943332 -0.53106120 -0.33139806 Al 5.99566214 8.00216760 2.05311494 0.15957593 0.19878400 -0.34106053 Al 3.99123788 10.02230636 2.04106314 -0.11562743 -0.32334658 0.30062762 Al 8.02457573 8.03106810 0.03975513 -0.70268037 -0.01624007 -0.22544727 Ti 10.03173997 10.05596376 0.01542131 -0.14053014 -0.27270362 -0.54771688 Ti 9.98273352 8.01889467 1.96290615 0.14346036 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0.06142332 0.06052511 -0.53416340 Ti 6.03886440 14.00203464 0.00916255 -0.10119186 0.12048822 -0.33733852 Al 6.00384495 12.00175852 1.98931440 0.00288055 0.11506589 0.82365230 Ti 4.02191132 14.01177570 1.98816339 -0.25864603 0.16187856 0.25017937 Ti 7.98951633 11.98755661 0.03966107 0.20771854 0.24626932 -0.50854583 Al 9.99335654 14.02693456 0.00766851 -0.05537563 -0.10924738 0.08283815 Al 10.02966702 12.02351316 2.00557676 -0.63338655 0.15759027 0.06684021 Al 8.04981562 14.01581784 2.07566213 -0.34152726 -0.12416187 -0.47994075 Ti 11.98264789 12.00058914 0.01990459 0.41718383 0.22818258 -0.53712573 Ti 14.03935464 13.98888735 0.00960856 -0.32939304 0.29856861 -0.51491696 Ti 13.97707861 12.02533441 2.03664417 0.37453769 -0.15346964 -0.34695003 Ti 11.97773047 14.01995697 2.02382219 0.29276245 0.17061396 -0.54517179 Al 15.99980493 12.01991179 0.06491647 -0.21098411 -0.19906415 -0.10822547 Al 17.98756928 13.98674922 0.00603550 -0.48887408 0.21578715 0.45245333 Ti 17.99415597 11.98116678 1.99503962 0.38813941 0.42460766 0.10104822 Al 15.98639149 14.03443620 1.97032304 0.43381281 -0.02308255 0.36353781 Ti 0.02106634 15.97725930 0.00019397 0.00386213 0.26000346 0.20710634 Ti 2.00783148 18.03425572 0.03582325 0.10695626 -0.31493565 0.27988019 Al 1.96688143 15.96125237 1.96692387 0.91443764 0.30225406 0.78360933 Ti 0.03153547 18.03770834 2.01921744 0.26787446 -0.54568113 0.04611618 Al 4.01537804 16.00790119 0.00419669 -0.24038025 -0.06473257 -0.03807613 Al 6.01428115 18.02766749 0.03170995 -0.12865878 -0.22974035 0.17378721 Ti 6.01567999 16.05360773 1.95963429 -0.18776470 -0.48373943 0.40099688 Ti 4.02064485 18.02855303 2.01611106 -0.42091867 0.00728530 0.00594334 Ti 7.98094015 15.99709429 0.02772147 0.30994986 0.21765822 -0.33483819 Al 10.04543345 17.99185646 0.03778820 -0.34825959 -0.13797516 0.29154934 Ti 10.03365544 16.01470947 2.03379129 -0.44304334 0.15883215 -0.40895997 Al 7.99804075 18.00600187 2.00339888 0.28562014 0.29137062 -0.09417003 Ti 12.00647017 16.05508347 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16.04960006 12.03968877 4.03163095 -0.33004953 -0.16640869 -0.54164045 Ti 18.01960524 14.01685786 4.03156315 0.45251409 0.22159029 -0.58781341 Ti 18.02587104 12.01691328 6.00488995 0.48949933 0.20127295 0.10359267 Al 15.98512693 14.05444255 5.98118207 0.45792711 -0.59631676 0.64451285 Al 0.06266224 15.98103415 4.02532969 -0.19915242 0.14614394 -0.58247527 Al 1.98834592 18.03238026 4.03449407 0.39360605 -0.28606175 -0.11138178 Ti 1.97204432 16.01516492 6.01027790 0.52597974 0.26879007 -0.17505544 Al 0.01105930 18.00069407 6.02827553 0.22146195 -0.32377074 -0.25939168 Al 4.03356854 15.99741703 3.99407881 -0.48655311 0.21639824 -0.20418894 Ti 6.02892447 18.03040560 3.98679463 -0.14102010 0.32914289 0.12003703 Al 5.96880777 15.98982219 6.00448905 0.24233010 0.08267434 0.05393956 Ti 4.04347750 18.03231455 6.02808835 -0.45577517 0.19080185 -0.27117974 Ti 7.97690100 16.02792318 4.01913139 0.11037483 -0.08844261 -0.18804660 Ti 10.02955423 18.02328701 3.96625623 -0.15100525 0.47149680 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