64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=277.8826466503374 stress="-0.0034146181347662085 0.00048630653405807797 -0.0009744166256265286 0.00048630653405807797 -0.0037280723929386194 -0.0016187539408709076 -0.0009744166256265286 -0.0016187539408709076 -0.0036158645099099514" pbc="F F F" Ti 35.06215363 35.05895731 34.97871075 0.84894999 1.17619242 0.79573328 Ti 36.50952489 36.71111631 36.71543266 -42.19828855 62.24835645 -32.72019283 Ti 37.48237957 37.79470789 34.74615600 -16.18947908 -28.47729627 -50.97737568 Al 38.00674983 38.70521220 36.32892690 21.08785269 28.03745750 46.46723167 Al 37.39878546 35.28489687 37.44629530 35.47592553 -72.43378249 26.93512424 Ti 38.54388832 36.64534354 38.82023254 135.90456284 -40.24133373 -55.76343572 Ti 34.90396910 38.27754257 37.37210135 -2.63294122 -0.15726023 1.08563312 Al 36.22666584 38.92313141 39.49169610 19.12218533 -31.46963747 -12.92099904 Ti 40.29781613 35.03644656 35.25705331 -0.72125112 0.72487497 0.22864028 Ti 41.94268670 36.13228039 36.82620385 -14.00869769 5.85268515 -6.33638208 Al 42.46784303 37.57933174 34.91495765 -3.20694437 0.57154237 -2.74900799 Al 44.04573242 38.25274383 35.44736045 1.80459510 0.76907861 2.29557128 Ti 43.38187880 35.00944149 37.04174452 11.58803176 -58.89982242 -80.93930230 Al 43.38555408 35.95130122 38.58542244 6.00113202 49.28031418 89.32196466 Ti 40.41248304 37.47555905 37.29217440 -3.58797816 4.12448867 -0.20439366 Al 41.67276050 39.68082320 38.44590517 -19.38748247 -4.91572308 4.62472550 Ti 34.98392833 39.17236630 35.08727912 1.18173527 0.46301813 -0.58244622 Ti 35.93573337 41.28577114 37.12586613 3.23522493 -1.95390989 -6.14453200 Ti 37.75238673 42.33193849 35.37229896 -12.19858718 -9.75632277 -9.93923345 Al 39.22423135 43.32623522 36.56447094 -98.12298653 123.80710518 -101.79707604 Al 37.26589929 39.48171872 37.31855080 4.57508021 -4.48791853 4.44974361 Al 39.22645041 40.63774106 38.80562055 -6.29130757 -2.17375937 2.56758818 Ti 34.58187383 42.46128760 37.77859614 -34.70874824 -5.42570312 -18.44200913 Ti 35.70046469 42.96786111 38.74906134 25.68024891 14.11082380 23.48782332 Ti 39.97343549 40.33959251 34.96953175 -13.14330572 -13.70566310 -15.38307291 Al 41.04814022 41.48360583 36.33041964 93.58600631 -65.59457971 -91.92905337 Al 42.06143014 43.07503521 34.90478082 -14.17934165 -4.80387662 -10.43043739 Ti 43.67045916 43.64064769 36.21295302 12.28209950 3.80636128 12.25109503 Al 42.23498056 39.82635824 38.24959429 20.64104843 4.11011045 -9.82078507 Al 43.41558829 41.06895543 38.79959894 3.13027139 1.36985375 0.02872923 Ti 40.17116535 42.34136491 37.52646854 32.97832357 -35.73033485 216.01472003 Al 40.99427559 44.08620588 39.00125142 0.92779262 2.37923286 2.40734429 Ti 35.13423686 35.12245546 39.85593507 -26.49530034 -38.77301037 -40.90698937 Al 35.95925024 36.31189841 41.07669840 26.13185490 39.82959229 39.78524053 Al 37.07683866 37.17605562 39.53916316 -128.51159184 46.57524764 63.02923548 Al 39.14804483 38.45270003 41.66945808 -67.92460720 88.84359383 -45.71481461 Al 37.33555050 35.51086837 42.38443897 0.60956188 0.16982803 -1.39084751 Al 38.55022516 35.63226538 44.07003161 1.30398391 0.82941219 0.69478440 Al 35.19518869 37.67924184 42.90985097 -53.55443875 -100.22881090 -86.95309212 Ti 35.84845996 38.89534720 43.95357008 54.99656438 101.12768176 85.52840268 Al 40.43842716 35.20145506 40.87854950 -17.01922143 -11.43068550 -14.47674504 Al 40.77564792 36.33901493 41.07807814 93.03187903 -109.28962131 -206.96223653 Al 42.06729992 37.55926057 39.49289041 -0.76092952 -1.47884964 -0.18638506 Al 43.19217473 38.46651206 41.02636215 0.57672044 -0.85022062 -0.24491467 Ti 42.20257175 35.12275460 42.11686492 26.61864043 -9.71180498 18.89942632 Ti 43.86738492 37.09446533 43.81545236 -1.40243234 0.53193888 -1.49339132 Ti 40.13412559 37.14634390 42.32540270 -37.03944975 41.52435224 245.82947821 Al 41.59153631 38.95929175 43.30326688 -1.13180315 -0.06360972 2.76130209 Ti 35.23489366 40.51501898 40.14982242 -43.24841082 25.77471653 -3.67822407 Ti 36.55853457 40.81518891 41.08057957 16.46893636 -3.65573198 20.95078440 Ti 37.28704872 42.35406774 40.32066476 -195.81539604 -204.48810305 -141.20183134 Al 38.26950531 43.39342509 40.98274438 203.05417308 214.44506321 137.07032797 Ti 37.84522213 40.47374615 42.79122224 -57.37732068 -16.89730636 -29.49412789 Ti 38.96081200 40.80631128 43.40775423 56.54576875 14.90740716 33.91974946 Ti 34.78942841 42.40056279 42.56750032 0.59052772 -1.31351144 -1.37574638 Al 36.56268116 43.77299294 43.96916549 1.60011803 -0.54997366 -0.44591898 Al 40.34513270 39.55465521 39.46948290 -2.22732753 -3.08296553 4.68755489 Ti 41.58676554 41.06362259 41.37726351 -52.27349517 50.86150358 -49.33767871 Al 42.82450966 42.62124183 39.78928253 -0.36254244 0.35639404 -2.63216767 Al 43.05321096 43.70606602 41.23882329 -0.84279368 0.96019401 2.75555456 Al 42.67957359 39.94278919 42.30813320 42.37983442 -81.05584582 31.40440480 Ti 43.42455666 41.63283301 43.11353308 12.45902557 28.95922124 13.97098545 Ti 40.24012985 42.25187288 42.43931928 -0.50934942 3.79974374 -1.10466300 Ti 40.77407161 43.97097912 43.89329941 0.65509436 0.76958839 0.43061016