108 Lattice="11.903817678095166 0.0 0.0 0.0 11.903817678095166 0.0 0.0 0.0 11.903817678095166" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-402.29852023862816 pbc="F F F" Ti 0.03247410 -0.00323547 -0.00243330 22 0.35750251 0.25236473 0.33869215 Al 2.01604501 1.98392577 0.03870643 13 -0.21571549 0.77039562 -0.55531268 Ti 1.98844426 -0.01442732 1.98652051 22 -0.31549059 -0.51733420 0.22334070 Al 0.00852949 1.99372178 1.97920131 13 -0.21639409 1.06140778 -0.30156303 Al 3.96297548 0.02230740 -0.01807850 13 -0.42586411 -0.38138352 -0.55752517 Ti 5.98854388 1.96387648 0.01042863 22 -0.26111257 0.48855297 -0.79222439 Ti 5.97138622 0.01003048 1.98389292 22 -0.35114684 -0.67362252 0.28190147 Ti 3.97220812 2.02069989 1.97939352 22 0.47026801 -0.43805429 0.37545913 Al 7.92521727 -0.01148584 0.01716528 13 0.65337487 -0.12849303 -0.10553728 Al 9.88712119 1.95091394 -0.01548414 13 -0.20090922 0.08022270 0.43047567 Al 9.95731272 0.01153104 1.95613452 13 -0.54775575 0.51206072 0.38651266 Al 7.91306488 1.94473691 1.96351430 13 1.41212388 0.26998630 1.13401636 Al 0.01061651 3.96060281 -0.02503343 13 -0.00489204 -0.89867495 0.25278525 Ti 1.94564331 5.92298323 -0.02871012 22 0.46737017 0.31217898 -0.56358609 Al 1.98338434 3.94341655 1.96926479 13 -0.78424836 -0.28420459 -0.54305092 Ti 0.00936830 5.98016362 1.97558096 22 -0.61819455 -0.33010498 0.34828271 Al 3.98502890 3.99832167 -0.00063706 13 -0.41744794 -0.32920821 -1.00381028 Al 5.96059247 5.91742946 0.00507315 13 -0.81162962 0.32438168 -1.30609232 Ti 5.96116773 3.93105710 1.97096716 22 0.27969808 0.02140700 0.15285231 Ti 3.96767690 5.94870503 1.94776230 22 -0.38570663 0.05082243 0.95315239 Ti 7.91216057 3.96983326 -0.02276276 22 0.01880840 -0.29419958 -0.39622697 Al 9.93724972 5.94781024 0.01269961 13 0.29634998 -0.02260777 -0.09702973 Al 9.95425124 3.98046145 1.96275447 13 -0.19818224 -0.42019880 0.46640443 Ti 7.88092240 5.96663665 2.01242350 22 0.32934887 0.16578148 -0.21047044 Al -0.03054998 7.88742080 0.01227885 13 -0.50017636 0.44658182 -0.86856390 Ti 2.01524815 9.92716072 0.01888635 22 -0.23859678 -0.02810545 0.13143050 Ti 1.98222899 7.88306953 1.95394828 22 0.21588282 0.31843171 0.56887472 Ti -0.03013689 9.88509864 1.97166446 22 0.33643190 0.25470166 0.06594294 Al 4.01513888 7.92417465 0.02673774 13 -0.07706535 -0.41704863 -1.64116166 Ti 5.95186690 9.94217206 0.00322507 22 0.28933189 0.32199861 -0.07336637 Ti 5.94917403 7.94600555 1.98031561 22 0.61252170 -0.08509596 0.48687490 Ti 3.95064018 9.89680074 1.94980448 22 -0.13668190 0.89642493 0.40170972 Ti 7.88022547 7.92507088 -0.01527809 22 0.28262148 0.23429680 -0.15956257 Al 9.94546949 9.93995684 0.01020210 13 -0.00073863 -0.03699741 -0.17036750 Ti 9.91240108 7.95622780 2.03359269 22 0.23511474 -0.31099934 -0.46788539 Ti 7.94524485 9.93360927 1.97565667 22 -0.36892499 0.28865627 -0.25809862 Ti -0.01853982 0.03707969 3.93256615 22 0.14663758 -0.17243155 0.27979403 Ti 2.02075907 1.99978868 3.99010005 22 -0.33476615 -0.14526109 -0.37548571 Al 2.02266309 0.03318937 5.98886935 13 0.52153089 -0.52806662 0.32863900 Ti 0.02473887 1.97121170 5.97274594 22 -0.92994476 0.29598230 -0.34170877 Al 3.96218830 0.01641249 3.92926084 13 0.38290455 -0.46493946 1.13906641 Al 5.97818876 2.01711934 3.99147873 13 0.73652644 -1.08242390 0.46632674 Al 5.91817787 -0.02578917 5.92988685 13 0.19672961 0.31996991 -0.25288105 Al 3.94484237 2.01002155 5.98518463 13 0.20767642 -1.17435688 0.36409080 Al 7.99435706 -0.02419280 3.95526370 13 -0.31500234 0.44640129 -0.07044219 Al 9.90143830 2.01129538 4.00661546 13 -0.40407739 0.52172243 -0.61502294 Ti 9.95649202 0.02025301 5.93485816 22 0.36192333 -0.24006528 0.19606499 Al 7.94128999 1.99260119 5.91505955 13 0.03643192 -0.44681869 -0.88878296 Al 0.03553782 3.99926084 3.99077180 13 -1.11447419 -0.33224657 -0.65266012 Ti 1.97995878 5.95714964 3.97211072 22 0.70364893 0.34853186 -0.52986663 Ti 1.98251724 3.96068053 5.92843210 22 0.15590505 0.18553298 0.31898607 Al 0.03924515 5.99824580 5.96259822 13 -1.63165222 -0.00474330 -0.36631911 Ti 3.98608172 3.94850427 3.92887232 22 -0.32690552 0.17536244 0.13505532 Ti 5.91621059 5.89329104 3.94873128 22 0.10152895 0.61891011 -0.28564472 Ti 5.92552449 3.97944409 5.97719400 22 0.29071645 -0.28401018 0.13081206 Al 3.97826966 5.96680678 5.93510690 13 -0.46472553 -0.42986420 0.58626732 Al 7.93355617 4.00564202 3.98815688 13 1.17093594 -0.94160276 0.18931469 Al 9.95157432 5.96729026 3.93999222 13 0.13094294 -0.91817730 0.70042145 Al 9.93205054 4.02107899 5.96919958 13 0.01499066 -0.26912478 -1.00573901 Al 7.89859222 5.93630483 5.98379531 13 1.31455919 -0.18119830 -0.87864631 Al -0.00081197 7.96476394 4.00140230 13 -1.10195019 -0.27898164 0.31546842 Ti 1.97694073 9.88755142 3.94129288 22 0.31996130 0.61343729 -0.40517751 Ti 1.97409277 7.92501443 6.00010705 22 1.28106303 0.11735722 -0.37499229 Al 0.03203187 9.89183079 5.99142120 13 -0.82612512 0.22730268 -0.21593029 Ti 3.99175839 7.94778172 3.96136316 22 -0.46902210 -0.26091874 -0.24059667 Al 5.99181717 9.91557920 3.96565735 13 -0.46253768 1.24569435 0.52133246 Ti 5.96113493 7.89875017 5.95924836 22 -0.07309580 -0.14623005 -0.00068551 Al 3.97017413 9.94063639 5.96974122 13 0.70624564 1.00099291 -0.40745980 Ti 7.92844556 7.93865560 3.96282747 22 -0.15301907 -0.85284088 -0.37899992 Al 9.91868668 9.92839299 3.97008310 13 0.34464215 0.76052171 0.42341200 Ti 9.92146646 7.96357303 5.98178693 22 0.65076682 -0.64140205 0.32091075 Al 7.92688096 9.88947457 5.89650551 13 -0.31558566 1.42915750 0.16474481 Al 0.05433015 -0.01215264 7.96504844 13 -0.09607575 -0.08866748 -0.46820252 Al 1.98400549 1.97979594 7.92403997 13 1.13058844 0.05138564 0.19770355 Ti 2.01517439 0.04659029 9.88959877 22 -0.29786298 -0.24574533 0.82919646 Ti -0.00918296 2.02170369 9.94141796 22 -0.03729944 -0.21698695 -0.02167741 Al 3.93022082 0.02814367 7.93963525 13 0.30314594 -0.07070489 -0.55328484 Ti 5.98782116 1.99758216 7.92818355 22 0.02965224 0.27951428 -0.55160791 Al 5.97480593 0.03133063 9.92964295 13 -0.45464182 -0.65937210 -0.06733632 Al 3.98253243 1.95460777 9.87107180 13 -0.22638345 0.76286084 0.09113106 Al 7.95892466 -0.00596173 7.89964359 13 -0.70400532 -0.89490766 -0.32732507 Ti 9.88809621 1.95145244 7.93789741 22 0.87567667 0.16965974 0.12810396 Ti 9.90549080 -0.00727154 9.92774774 22 -0.34170036 0.42945220 -0.30691670 Ti 7.90593060 1.94932070 9.93274383 22 0.74192055 0.43632336 0.53760219 Ti 0.03658889 3.97943322 7.93462327 22 -0.89466592 -0.06643098 -0.06500379 Ti 1.94941729 5.98999547 7.96815768 22 0.63265733 -0.36531460 -0.19740893 Al 1.95118593 3.94761234 9.94352495 13 1.34181683 -0.31559481 0.32163691 Ti -0.01703236 5.96451039 9.92390163 22 -0.22110135 -0.10380048 0.15326024 Al 3.95645622 4.00617116 7.91619812 13 -0.57889364 -0.46254653 0.92660137 Ti 5.95534344 5.97110629 7.97301204 22 0.14028181 -0.25986221 -0.37540546 Al 5.91301420 3.90471310 9.95844174 13 -0.64591330 0.41607545 0.54520379 Al 3.94270868 5.95564439 9.94744722 13 -0.04916426 -0.30678309 0.58169127 Ti 7.94854039 3.93915601 7.91018703 22 -0.57826676 0.10042660 0.66007440 Ti 9.95807702 5.93259935 7.96470340 22 0.24818462 0.58562764 -0.02684714 Ti 9.87658769 3.97271156 9.88851148 22 0.12268631 -0.31080528 0.27328808 Ti 7.90243108 5.95593775 9.90047131 22 0.18335430 -0.29632577 0.47295363 Al 0.01390897 7.91980148 7.90145803 13 -1.19366537 0.37343192 0.39081005 Ti 2.01301543 9.89375476 7.92000472 22 0.07189958 0.89680800 -0.07452828 Al 1.97088533 7.98131695 9.93240295 13 0.09043364 -0.11347883 0.75168201 Al 0.01110704 9.88543500 9.95320998 13 0.11946694 -0.41914053 -0.25984692 Ti 3.96569448 7.94450906 7.92496314 22 -0.27293649 -0.55514589 -0.39183589 Al 5.97925855 9.91958961 7.91457003 13 -0.46324232 0.83418398 -0.10160421 Al 5.92008256 7.91333782 9.89909429 13 -0.38830555 0.76610811 1.13670298 Al 3.95529825 9.92095949 9.89388314 13 0.52166016 0.02475157 0.41311604 Ti 7.91603106 7.96561282 7.94621770 22 0.47338807 -0.59096145 -0.29888758 Ti 9.91860623 9.92391787 7.91388287 22 -0.11447144 0.18956229 -0.05707825 Al 9.89175320 7.97393740 9.95631829 13 0.60437593 -0.31834631 0.38598876 Ti 7.92320769 9.92103153 9.88871635 22 -0.10585318 0.35925577 0.12711193