256 Lattice="16.33910852023542 0.0 0.0 0.0 16.33910852023542 0.0 0.0 0.0 16.33910852023542" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1125.9001523837644 stress="-4.370007566217424 0.2260774414653297 -0.34238790270934416 0.2260774414653297 -4.386493459140562 -1.2062116241392857 -0.34238790270934416 -1.2062116241392857 -5.310169628051679" pbc="F F F" Ti -0.00924159 0.02793828 -0.03039694 0.49061597 0.45739009 0.53475496 Ti 2.01444205 2.05615337 -0.03822304 0.02505887 0.01130677 0.06337526 Ti 2.03743650 -0.02549079 2.04360060 -0.17017106 -0.05908706 -0.01938966 Ti 0.02546136 2.02808283 2.08208266 -0.09286002 0.06129330 -0.16789691 Ti 4.06070283 0.00360360 0.03648313 -0.02430936 0.28377673 0.22834444 Ti 6.07943300 2.05932070 0.00927753 0.14815581 -0.22338434 -0.06148847 Ti 6.16388311 0.00351503 2.02965292 -0.15259407 -0.15188006 -0.21849219 Ti 4.01104491 2.06531276 2.07360180 0.24107819 -0.21457060 -0.39713870 Ti 8.23004662 0.02239178 -0.03448672 -0.15837385 0.31272434 0.33062610 Ti 10.24511257 2.03479457 0.01668190 -0.11047772 0.10677721 -0.16142375 Ti 10.21571628 0.01535577 2.06486352 -0.07444249 -0.15526571 -0.17959043 Ti 8.14529508 2.06316303 2.06514548 0.29798973 -0.10911897 -0.22610117 Ti 12.23283513 -0.01606694 0.02870639 0.07165426 0.21039775 0.16858086 Ti 14.33211081 2.02653550 -0.01272668 -0.35031042 0.12698552 0.15156467 Ti 14.33607086 0.03203274 2.01340447 -0.27164810 0.10108408 0.15299909 Ti 12.30142982 2.01542681 2.00435660 -0.13567119 0.17779255 0.18052455 Ti -0.00745505 4.12015719 0.03478777 0.19459362 -0.28626065 0.16484345 Ti 2.05001773 6.08759405 0.03346291 -0.06991283 0.31624316 -0.30435220 Ti 2.06163434 4.10247964 2.04812627 -0.33881415 -0.23800082 -0.24617366 Ti -0.02077055 6.10236037 2.02461066 -0.11221398 0.25636420 0.21878551 Ti 4.11096363 4.08179702 -0.03047491 -0.08963422 -0.04614838 -0.08275491 Ti 6.15279581 6.13974680 -0.00435825 -0.12270824 -0.19843685 -0.08046337 Ti 6.13038741 4.03608118 2.07745461 -0.09445814 0.27812546 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0.20595208 0.16449320 -0.23983151 Ti 2.04375683 2.06421394 4.05786759 -0.12485370 -0.10496995 0.31408971 Ti 2.08032371 0.01294876 6.05376421 -0.17784303 -0.22931452 0.19491670 Ti -0.01619373 1.99939191 6.14878909 -0.15083408 0.18650288 -0.11680603 Ti 4.11061934 0.01437064 4.07044015 -0.12938879 -0.26090271 -0.22862698 Ti 6.10496321 2.01105647 4.05335733 0.12217697 0.18421832 0.29486678 Ti 6.09761034 0.00581437 6.10627643 0.33196600 -0.22943278 0.06835830 Ti 4.10067215 2.00364804 6.15530762 -0.16459887 0.33663056 -0.17177355 Ti 8.18004208 -0.02037002 4.04592798 -0.10735949 -0.11710488 0.22892094 Ti 10.22135701 2.00896336 4.12237681 0.08987656 0.47223486 -0.34746260 Ti 10.21754008 0.03858262 6.10161236 -0.12803026 -0.40800123 0.26127960 Ti 8.19138161 2.06151408 6.14397322 -0.21945883 -0.31710913 -0.16737927 Ti 12.21594885 -0.00671696 4.04862380 0.36382858 -0.21654193 0.05237737 Ti 14.26157607 2.01714361 4.09354739 0.14384930 0.13361996 -0.13820352 Ti 14.27545321 0.03725209 6.16152137 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4.10657658 4.07460036 8.14659747 -0.26688255 -0.10683144 0.06400645 Ti 6.14989736 6.09352315 8.19610265 -0.00045169 0.26442240 -0.31015374 Ti 6.12190568 4.11248934 10.17910396 0.10812099 -0.28833818 0.36877827 Ti 4.11084926 6.16232335 10.18311539 -0.27223257 -0.17872593 0.13092198 Ti 8.15229273 4.02535569 8.14848967 0.06539923 0.17034417 0.21298007 Ti 10.17797024 6.10655892 8.14428511 -0.05466577 0.14788069 0.15353992 Ti 10.19655328 4.02778634 10.17465503 0.05901866 0.22208712 0.10493055 Ti 8.13644029 6.15315493 10.23852414 0.25552019 -0.11333182 -0.09641023 Ti 12.28364192 4.10627571 8.13214096 -0.11329549 -0.04474818 0.01405832 Ti 14.26102706 6.14773313 8.18002488 0.33092695 -0.08146002 -0.18748446 Ti 14.30171104 4.06543070 10.17299303 0.11394443 0.11594997 0.16389760 Ti 12.23829049 6.13833143 10.18653417 -0.02067455 -0.22585115 0.16808519 Ti 0.01730886 8.16921530 8.13135368 -0.32735150 0.04302634 0.23803645 Ti 2.01153701 10.19637576 8.14405395 0.12529128 0.19648955 0.16616760 Ti 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-0.35084029 -0.17292059 0.19008882 Ti 12.21743276 -0.00077082 12.27232822 0.10209753 -0.07161879 -0.16165926 Ti 14.26079718 2.06819719 12.23129932 0.14473485 -0.22586541 0.03435802 Ti 14.25686326 0.02451756 14.28729532 -0.38048488 0.45120002 -0.46065182 Ti 12.21761346 2.02225348 14.26221089 0.10716482 0.09598705 0.26643525 Ti -0.02403246 4.10401145 12.29125429 0.04542870 -0.19429657 -0.20193687 Ti 2.02499237 6.15404454 12.28005132 0.21781008 -0.16729989 -0.12875093 Ti 2.06873612 4.12389802 14.31102494 -0.13791528 -0.39317200 0.06863053 Ti 0.03352072 6.09976077 14.31427143 0.07361905 0.21359862 -0.11506275 Ti 4.11835848 4.07863300 12.28078752 -0.29923754 0.01778979 -0.37034661 Ti 6.11808844 6.10900023 12.26684949 0.11251213 0.09300365 -0.08734889 Ti 6.10879366 4.09768577 14.26198411 0.36298466 -0.09767667 0.34345860 Ti 4.08981490 6.10340067 14.27416591 -0.10760255 0.35353371 0.28945129 Ti 8.20189736 4.06504339 12.26775558 -0.34857875 0.12715747 -0.15960252 Ti 10.19696911 6.15592100 12.22907263 0.32736421 -0.22512510 0.09772706 Ti 10.19509656 4.07242715 14.27078265 0.22129351 0.26070958 0.32852528 Ti 8.19952633 6.16268761 14.25661714 -0.14852038 -0.19965340 0.40018786 Ti 12.22064420 4.05496994 12.23467267 0.19779305 0.28695749 0.02174522 Ti 14.30659567 6.15057763 12.22104093 -0.10300823 -0.19214552 0.07109855 Ti 14.32530383 4.04242650 14.27238128 -0.38679729 0.10491258 -0.24519238 Ti 12.24971325 6.13548849 14.33737333 0.05108792 -0.14013094 -0.21128097 Ti 0.02959026 8.18907644 12.25897789 -0.31089763 -0.12341388 0.10247439 Ti 2.05046427 10.17438705 12.24940605 0.15758012 0.01056302 0.02659076 Ti 2.03162150 8.20843503 14.32219121 0.16838242 -0.10473493 0.12336897 Ti 0.01014022 10.24235707 14.29995733 0.13162649 -0.01330050 -0.16269530 Ti 4.12138907 8.16308872 12.24220367 -0.31717019 -0.02927877 0.07499614 Ti 6.10427096 10.18968345 12.25936372 0.18936432 0.14453747 -0.11500242 Ti 6.10868146 8.19079138 14.28840072 0.14344151 -0.16254017 0.23521269 Ti 4.12358720 10.22147629 14.27155251 -0.33762008 -0.08554471 0.29459953 Ti 8.18940364 8.13482156 12.29014689 -0.30115868 0.23467708 -0.16763192 Ti 10.17816034 10.19925245 12.22464384 0.32877397 0.16186430 0.30474223 Ti 10.22717463 8.19272760 14.30917936 0.14656040 -0.05357584 0.15300978 Ti 8.20062826 10.19563001 14.27429225 -0.12227470 0.05102033 0.26160635 Ti 12.23971614 8.19641196 12.22104355 0.18751817 -0.03085023 0.37758085 Ti 14.30650868 10.18922105 12.23211397 -0.03162209 0.11502797 0.24232391 Ti 14.30131908 8.14833523 14.27628087 -0.27320635 0.09459002 -0.19953469 Ti 12.23599551 10.22199066 14.32869947 0.25331877 -0.09133540 -0.08542668 Ti 0.02160285 12.21757604 12.25988275 -0.26919094 0.12539641 0.03640691 Ti 2.02686841 14.25983330 12.24572695 0.09488971 0.20595223 0.22953916 Ti 2.05567297 12.22742408 14.27983057 -0.08880643 0.13699402 0.21939178 Ti -0.02429074 14.27873951 14.28900959 0.52519875 -0.52772208 -0.49763776 Ti 4.06749158 12.24735337 12.27648417 0.20260151 0.14704053 -0.28945158 Ti 6.15932355 14.32465806 12.22523449 -0.29597197 -0.05650618 0.02278367 Ti 6.12123667 12.21520027 14.29300858 0.15520940 0.14607062 0.13028693 Ti 4.12804380 14.25933079 14.31842492 -0.10577372 -0.15310634 -0.31458298 Ti 8.14549085 12.23972507 12.27553326 0.03939319 0.07355785 -0.12748926 Ti 10.18291604 14.30689430 12.24565017 0.22806437 -0.00500889 0.08488291 Ti 10.24249594 12.22566255 14.29706684 -0.15368534 0.19714839 0.10051600 Ti 8.15817455 14.26011327 14.26806005 0.04621480 -0.17221458 -0.05639371 Ti 12.23321482 12.26124004 12.28183364 0.07702717 -0.09202668 -0.18776653 Ti 14.26238166 14.28216983 12.24782358 -0.23867306 -0.21438940 -0.16088560 Ti 14.27877011 12.28588524 14.26928270 -0.20130916 -0.24579748 -0.19788745 Ti 12.25233999 14.30535636 14.31892590 -0.16990682 -0.20912539 -0.29641105