64 Lattice="10.0 0.0 0.0 0.0 10.0 0.0 0.0 0.0 10.0" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=10114.093153608323 pbc="F F F" Al 0.02406454 0.07742389 -0.19233898 13 0.52989609 0.63476596 0.57230933 Ti 1.45177176 1.77827796 1.88793279 22 43.19460485 -9.68997332 -15.52648719 Ti 2.73397328 2.19947704 -0.23414229 22 -1.36565530 -2.92721975 -2.47209048 Al 3.87414001 3.84355442 1.12276968 13 0.05664488 -3.49539089 7.37933218 Al 2.33924335 -0.13442315 2.55948738 13 3.93450194 -12.14478293 2.15067309 Ti 3.48203926 1.40131030 4.17903887 22 16122.94629034 -18778.26518765 -13343.97568612 Al -0.27355028 2.50741549 2.32871237 13 -77.53019205 -9.87961362 -26.71572515 Ti 0.72255623 3.50258074 3.61767693 22 101.84664191 -90.24737888 -27.29845159 Al 5.13417716 -0.23618962 0.05400608 13 -1.66920981 -0.62941878 -0.63046253 Al 6.13322476 1.02091625 1.09209862 13 -34.08343293 -30.20342603 22.44848002 Ti 7.40251465 2.21757405 0.26717165 22 21.09691664 12.87993664 -40.24945488 Ti 8.08315697 3.29220975 1.30895731 22 12.45801800 17.48860413 17.90791687 Ti 7.47871075 0.41077475 3.21418467 22 -20.57598395 -4.94931891 -9.76066684 Ti 9.02987167 0.75783351 3.82393348 22 21.53396049 5.97619866 9.22084929 Al 4.89925681 2.22878954 2.79616145 13 11.47943397 6.73264395 -12.32322344 Al 6.25373193 3.52245446 4.23966376 13 -157.37364154 198.06428387 -145.39634349 Ti 0.32912535 4.86003540 0.48941736 22 -1.12697104 -3.64496513 -0.46253243 Ti 1.71197274 6.42569281 1.19920856 22 -30.20082439 -26.04280576 28.14241978 Al 2.95364255 7.19800497 0.01992854 13 27.20837375 4.39761544 -52.13775242 Ti 4.10881060 8.71523541 0.73663362 22 15.01435650 23.69124079 9.09488230 Al 2.82407760 5.22912234 2.79564350 13 -171.81664418 -219.34428428 -86.96357220 Ti 3.77914461 6.40002758 3.30711055 22 173.90166216 215.19644903 90.18252944 Al -0.02853731 7.03284484 2.26861462 13 -15.05749283 4.95800004 10.30606949 Al 1.39876856 8.98140506 3.63692653 13 0.98800136 -1.11141641 -0.05361278 Al 4.20554359 4.81613781 0.33926838 13 2.72674331 6.52552652 -4.47756102 Ti 6.61474036 6.99578313 1.22424358 22 -15823.10839880 -23272.13266797 26240.94420688 Al 6.96940668 7.50493337 0.63900690 13 16077.00062109 23078.63602511 -26531.46559089 Al 8.31589017 8.90166206 0.86222393 13 2.30330843 2.78787425 0.94910392 Ti 7.47936569 4.82065853 2.85615900 22 -6.09077970 -1.64174487 -6.12709672 Ti 8.82095552 6.10074876 3.14092701 22 8.45926011 9.96592697 1.96114060 Al 5.70596994 7.66501608 2.25075152 13 -261.21569210 65.52267559 225.12026364 Ti 5.78970001 9.18504785 3.08354306 22 2.36795595 124.51171380 62.39919037 Al 0.04627288 0.31634185 5.11736201 13 -2.34577230 1.25605931 -1.60905756 Al 1.69338563 0.28227195 5.76253219 13 1.71680491 0.02987914 -1.29755573 Al 2.96435681 2.00374871 4.60761187 13 -16133.06256156 18775.70363670 13356.75843294 Al 3.89989600 3.70853506 6.62095317 13 -1578.00569943 541.61186352 -765.86601812 Ti 1.93907329 -0.02577031 8.17899317 22 0.34245526 0.83228614 2.96928501 Al 4.03248616 1.69179447 9.08923254 13 -0.08168739 0.46144742 -0.75371481 Ti 0.07268426 2.10576939 7.93257021 22 -1.48859383 -3.27572899 -2.77573041 Al 1.57705703 3.78088669 8.83017931 13 -152.63220315 -50.92594672 154.28946502 Ti 5.84458459 0.51272138 4.84156512 22 -2.35986782 -5.13151331 -1.34337214 Ti 5.85125531 1.87203955 6.53878191 22 4.17053542 -17.69178561 2.83263593 Ti 7.07497475 2.42726008 5.05582777 22 138.74516320 -221.23502654 123.01793342 Al 8.12110251 3.63724412 6.24330553 13 21.72677353 20.68715359 20.46412654 Ti 7.34020603 0.16332399 7.21119550 22 -100.75932888 -49.79763594 -61.87410321 Al 8.72331683 0.83028319 8.05208472 13 101.04325445 50.20424368 61.10377008 Ti 5.03526283 3.31368554 7.04855426 22 1701.47412421 -577.66149524 651.03717190 Ti 7.03979952 3.81961223 9.06772639 22 -1.23400916 -6.68265359 4.25655538 Al -0.06398002 4.83369125 4.35709533 13 -70.63862194 121.00529162 66.66135356 Al 1.44788259 5.96126242 6.18204241 13 -24.76984997 -19.58502271 13.87201014 Ti 2.89134611 7.08051348 5.35139000 22 17.99038790 11.98756197 -17.22260662 Al 3.68520517 8.97209863 6.23326608 13 3.16452150 10.78893778 3.64408900 Ti 2.71460486 4.17595939 7.71126505 22 21.46017430 105.05642304 -31.26347733 Al 3.42811074 6.35789062 8.89340285 13 -13.34819499 -5.42751094 14.44266336 Ti 0.35548371 7.64005940 7.93636409 22 -24.07797166 -15.75811073 -20.85029206 Ti 1.44850718 8.32813304 8.85163910 22 25.76403371 15.15977159 19.86077875 Al 4.59352323 5.20042083 5.35398338 13 -92.87197091 -133.04907246 -61.08441830 Ti 5.52320523 6.48746071 5.94177835 22 104.43568448 125.10394408 41.48817939 Ti 7.03412872 8.23908735 4.42247784 22 4.50732965 -3.69182945 4.52465634 Al 8.34085204 8.58596686 6.77488311 13 -0.66734510 -0.65831580 0.87029546 Ti 7.15528834 5.32789968 7.72606681 22 -100.30010312 -66.76275962 -59.31084480 Al 8.41731400 6.28615860 8.44449355 13 98.07503846 75.24017870 55.60869061 Ti 4.81985461 7.01637850 7.44673886 22 6.18229917 11.37614177 5.71209103 Al 5.98076832 9.13074023 9.21385728 13 0.01292792 -0.79029798 -0.90604978