108 Lattice="11.913362707177066 0.0 0.0 0.0 11.913362707177066 0.0 0.0 0.0 11.913362707177066" Properties=species:S:1:pos:R:3:forces:R:3 energy=-328.7680033199609 stress="-0.005249508418212329 0.00014021141279846447 9.863032067843974e-05 0.00014021141279846447 -0.00487085678590447 -0.00020645836878445536 9.863032067843974e-05 -0.00020645836878445536 -0.004875822099483821" free_energy=-328.7680033199609 pbc="F F F" Al 0.01185842 0.00560077 0.01773840 0.37039494 0.36264109 0.37555055 Al 1.99043761 1.93665552 0.01971831 -0.28335107 0.13333260 -0.35527715 Al 2.01687829 0.03434243 1.95589141 -0.32460094 -0.36496935 0.14773748 Al 0.02416120 1.98655189 1.95697786 -0.19469429 -0.12057037 0.02764973 Al 3.97305073 0.06246454 0.05230886 0.07551324 -0.20808527 -0.20707765 Al 5.93063876 2.00750549 0.02162406 0.28990704 0.00353908 -0.26102469 Al 5.99402234 0.00258713 1.93804670 -0.06466282 -0.20990457 0.12270605 Al 3.97504893 1.96172765 1.96010506 0.01140284 0.21129537 0.34413104 Al 7.97131313 0.02289188 0.00854564 0.05961702 0.22174166 0.08734571 Al 9.96482581 2.02797329 0.00180523 -0.26523629 -0.08496458 0.28104632 Al 9.89762648 0.00850565 1.97753075 -0.03371567 0.09442312 -0.11886155 Al 7.96872945 1.94012572 1.99944513 -0.08342700 0.24252241 -0.35406580 Al 0.02106400 3.99901156 0.01885773 0.07714790 -0.09551736 0.04671432 Al 2.00230836 5.92328086 0.01066903 -0.08851009 0.21008317 -0.24849756 Al 1.97378157 4.00353014 1.97540790 0.13005422 -0.21411203 0.15040039 Al 0.02913150 5.93963310 1.99908956 -0.25062660 0.12362576 -0.13134678 Al 3.93597159 3.93970720 0.03029582 0.07052709 0.04943098 -0.34066126 Al 5.95024308 5.94012353 0.00591761 0.06051438 0.05149416 -0.29974901 Al 5.93500820 3.98785378 1.99224428 0.08692227 -0.18248504 -0.11526696 Al 4.00717099 5.97478536 1.94618060 -0.22409644 -0.07982611 0.25770646 Al 8.00432016 4.00724407 0.02444661 -0.08903836 -0.16922476 -0.20883545 Al 9.95780041 5.97089082 0.01253742 -0.20175814 0.06696850 0.18186089 Al 9.90190842 4.00429516 2.01413519 0.34945973 -0.11847718 -0.19471863 Al 7.92366361 5.93252511 1.99713751 0.21739974 0.19150033 -0.11048222 Al 0.03254864 7.91255086 0.02396325 0.12507124 -0.02355128 0.13568397 Al 1.92422857 9.89869184 0.02326147 0.12152813 -0.07585543 0.01816132 Al 2.01093476 7.97551062 2.01271776 -0.26633064 -0.28117890 -0.26491297 Al 0.02885687 9.91689693 1.92114524 0.02282585 -0.14182758 0.12762314 Al 3.95137083 7.95629242 0.03115403 0.12708540 0.10637051 -0.27617771 Al 5.96836741 9.93602790 0.00881124 -0.04435119 -0.21315604 0.26639998 Al 5.99099667 7.90418521 2.02412430 -0.15844609 0.28289883 -0.29464842 Al 3.93541030 9.89182288 2.01210559 0.20484873 0.39539138 -0.25318161 Al 7.92448523 7.98036982 0.03031089 0.28900234 0.08864812 -0.13743178 Al 9.94322542 9.95767604 0.01010503 -0.53976241 -0.54001832 0.54547430 Al 9.93844949 7.92565477 1.99522534 0.03537863 0.28008970 -0.15030370 Al 7.93708902 9.95163787 2.00999740 0.28000004 0.09845661 -0.19230015 Al 0.03495655 0.00746900 3.99282450 0.11650720 0.13285408 -0.12732360 Al 2.00024479 1.98757371 4.00162045 -0.16572625 0.01198829 -0.32405071 Al 1.96399821 0.03530904 5.96838323 -0.01606881 -0.37273269 0.05321323 Al 0.01854529 2.00160567 5.92692780 -0.30528163 -0.13526736 0.08251211 Al 3.98395002 0.03044683 3.98552537 0.05817353 -0.30107719 -0.09959245 Al 5.96465519 2.02192538 3.97446095 -0.08950215 -0.27215354 -0.11727797 Al 5.98668768 0.00947030 5.97239583 -0.04455790 -0.19845067 -0.10146480 Al 3.93322503 1.97105681 5.92816926 0.31687515 0.06464974 0.21945312 Al 7.94259819 0.00171081 3.94451299 0.02602890 -0.27113694 0.15492072 Al 9.89265127 1.97983377 3.93595138 0.35537998 -0.12752640 0.13624934 Al 9.89904650 0.00366271 5.99546472 -0.11514659 0.15961841 -0.12344661 Al 7.92602636 2.00360932 5.92376576 0.10041002 -0.07336054 0.14499757 Al 0.03702546 4.00417077 3.97455360 -0.29276813 -0.15387219 -0.08253967 Al 1.99820118 5.98711181 4.00457503 0.17767425 -0.08863390 -0.14960679 Al 1.95912940 3.99243267 5.97440516 0.19971299 -0.06130492 -0.10574825 Al 0.02360477 5.93988522 5.94092596 -0.33415148 0.10760207 0.13486435 Al 3.96921564 3.96010549 4.00625164 -0.16324476 0.08822733 -0.28068316 Al 5.95209469 5.92071405 3.98141007 -0.10966836 0.14890379 -0.05921260 Al 5.93197500 3.98483567 5.94255366 0.17740235 -0.21559240 0.25277095 Al 3.99750507 5.93427925 5.98192292 -0.22583345 0.20456748 -0.06660427 Al 7.92312088 3.95869108 3.94283812 0.11725082 0.08983404 0.11837894 Al 9.96501058 5.93210840 3.96638041 0.06372579 0.16393221 0.10624434 Al 9.92709296 3.92875330 5.91883455 0.12809742 0.16816038 0.11902154 Al 7.92373444 5.96674999 5.92505357 0.32089732 -0.17996795 0.10428499 Al 0.02134155 7.90558326 3.94398337 -0.30856054 0.19231361 0.05471083 Al 1.95616927 9.89397677 3.96236481 -0.03070278 0.34076056 0.09251616 Al 1.96900240 7.95174662 5.99560888 0.15019405 -0.03056099 -0.13677140 Al 0.04670443 9.90551586 5.93423252 -0.03251062 -0.07744390 0.05090407 Al 3.96449331 7.96166333 3.95006251 0.09596209 -0.22267302 0.28057137 Al 5.92970184 9.91864581 3.95713104 0.16251954 0.24854064 0.03430634 Al 5.98882277 7.90349490 5.95511310 -0.14918197 0.30344605 -0.08752617 Al 4.01037753 9.93475468 5.91673404 -0.13516331 0.17855622 0.13523885 Al 7.91265106 7.93767385 3.96508533 0.42035886 0.17528886 0.06330740 Al 9.96087789 9.95491640 3.97944388 -0.31440644 -0.31557423 -0.00473459 Al 9.90852784 7.96328500 5.99634234 0.14039621 0.08274461 -0.16324923 Al 7.94192244 9.95799256 5.97867118 0.09646924 0.08856292 -0.13681159 Al 0.02150553 0.02359377 7.95633795 0.16204394 0.23072536 0.02544418 Al 2.01664640 2.00627978 7.92999710 -0.25581632 -0.21377511 0.18000086 Al 1.99443901 0.03024004 9.89459735 -0.06988047 0.15283973 -0.16024373 Al 0.00037386 1.99598504 9.91700653 0.19494109 -0.09892263 -0.18696510 Al 4.00725194 0.03519544 7.93644334 -0.09791189 -0.25684707 0.10149059 Al 5.99344646 1.94748107 7.97311566 -0.16274625 0.25549629 -0.11382848 Al 5.95890793 0.03888163 9.93442444 0.03484432 0.07954450 -0.07285870 Al 3.94091733 1.99751043 9.94697223 0.09835068 -0.08977203 0.18678910 Al 7.96413374 0.02659808 7.93578829 0.14128471 -0.27408902 0.28769367 Al 9.89345009 1.99205713 7.93020267 0.24719504 -0.13580363 0.23137723 Al 9.90517680 0.00200567 9.95916532 -0.47712925 0.50167208 -0.50054434 Al 7.94893962 2.01927097 9.93165272 0.18837594 -0.31255545 0.26454102 Al 0.02937233 3.92966608 7.92060568 -0.34570749 0.09675486 0.18889404 Al 1.99525917 5.92055784 7.96983332 -0.01837798 0.11928706 -0.06348063 Al 1.95028516 3.95832589 9.95229544 0.08843807 -0.02186310 0.19186847 Al 0.05408587 5.91927885 9.94014112 -0.00861600 0.05835190 -0.11855720 Al 3.95901681 3.93837619 7.93656086 0.18863802 0.08675718 0.15415176 Al 5.96932867 5.96793944 7.91431900 -0.12055947 -0.15152953 0.22518920 Al 5.95434819 3.95416279 9.94458251 -0.08015564 0.11499501 0.12035173 Al 3.95607376 5.99473453 9.92170798 0.11039884 -0.20105296 0.13265825 Al 7.94562093 3.99069758 7.97487106 0.01675331 -0.05030166 -0.19501470 Al 9.89621282 5.97799862 7.96936727 0.24999836 -0.13996382 -0.06431468 Al 9.89686151 3.94819730 9.95615214 -0.08668828 0.07482102 -0.15668376 Al 7.92468447 5.98454361 9.89775553 0.11867721 -0.10989756 0.37198903 Al 0.02850297 7.91546166 7.93828361 -0.26602226 0.16616920 0.24169293 Al 1.95613452 9.93332521 7.94587438 -0.03541618 0.17356491 0.21424845 Al 1.99670410 7.90624980 9.91628109 -0.15832966 0.36917534 0.16121519 Al 0.00140368 9.89164873 9.93167437 0.45977881 -0.45536432 -0.45265422 Al 3.98274267 7.98416584 7.90422112 -0.09013987 -0.05549680 0.18251442 Al 5.98285272 9.89270808 7.96295197 -0.10228560 0.33371846 -0.03055610 Al 5.95704446 7.91920182 9.90396262 -0.10198391 0.17318465 0.30354270 Al 3.97859426 9.94201114 9.90848517 -0.04578884 -0.21819422 -0.16719692 Al 7.93393523 7.95091306 7.95925690 0.20358185 0.12034067 -0.07323607 Al 9.92740220 9.96016023 7.93875178 -0.23444221 -0.22636380 0.06318746 Al 9.91063605 7.96451685 9.89831422 -0.13142582 0.08243045 -0.13881251 Al 7.93187940 9.91158056 9.90707500 0.10256995 -0.12198765 -0.10708613