108 Lattice="13.303628335057397 0.0 0.0 0.0 13.303628335057397 0.0 0.0 0.0 13.303628335057397" Properties=species:S:1:pos:R:3:forces:R:3 energy=-138.35298338319274 stress="-0.001913558786367797 5.0452649337050855e-05 -1.587421827057758e-05 5.0452649337050855e-05 -0.001965903804996308 0.0001873623518107407 -1.587421827057758e-05 0.0001873623518107407 -0.0018225970444864497" free_energy=-138.35298338319274 pbc="F F F" Mg 0.02070949 0.00484576 0.01432625 0.21519537 0.18695557 0.18439191 Mg 2.17301974 2.25127130 0.01608544 0.17615202 -0.15796533 -0.25084251 Mg 2.23247195 0.04060865 2.20632965 -0.02879931 -0.23163454 -0.02535552 Mg 0.04050320 2.18801694 2.16080731 -0.25489030 -0.04153058 0.13225306 Mg 4.44511825 0.01754832 0.00191046 -0.05377582 0.12061036 0.14783259 Mg 6.62210116 2.17801835 0.00409014 0.08153647 0.06598294 -0.09349425 Mg 6.69512347 0.02160483 2.23742652 -0.15629240 -0.20915275 -0.09018034 Mg 4.39778600 2.25861765 2.25417811 0.12185828 -0.13244720 -0.23904744 Mg 8.87291884 0.01411588 0.03398163 0.04577842 0.09881207 0.05776242 Mg 11.12371511 2.18542072 0.01313456 -0.18828798 0.02305815 0.11924278 Mg 11.09507079 0.02635940 2.17572085 -0.13088595 0.13458038 0.05817409 Mg 8.85149154 2.19174395 2.20497050 0.18313216 0.09803855 -0.05222222 Mg 0.03923043 4.40199800 0.02660303 -0.05624233 0.09440883 -0.03252914 Mg 2.26795708 6.62608018 0.02946315 -0.10970418 0.10637786 -0.26310375 Mg 2.19225501 4.46272998 2.19591909 0.10942408 -0.10071474 0.07947431 Mg 0.04155047 6.62437360 2.21197769 -0.23930432 0.11090379 -0.09894494 Mg 4.47628146 4.42521136 0.01124362 -0.03033613 -0.05817499 -0.15299833 Mg 6.61649548 6.70217979 0.02346450 0.16139168 -0.11102486 -0.18553529 Mg 6.69420862 4.44962384 2.26074168 -0.08478663 -0.08404385 -0.15717303 Mg 4.45407365 6.62692699 2.19220282 -0.06991385 0.06048629 0.14640370 Mg 8.90497095 4.45623076 0.00705323 -0.07490636 -0.07855240 -0.12816690 Mg 11.12224920 6.60854558 0.04383780 -0.14264575 0.12531026 0.07172513 Mg 11.09412070 4.42238955 2.17844228 0.13887922 -0.09083264 0.04910213 Mg 8.86398453 6.64507426 2.25420688 0.04990453 0.06815459 -0.10890156 Mg 0.03027831 8.87764322 0.01861945 0.19653599 0.04699650 0.18155124 Mg 2.24077028 11.13064629 0.03371345 -0.03270528 -0.20681026 0.19226276 Mg 2.24182738 8.86482596 2.20548781 -0.10097642 0.05790573 -0.12653993 Mg 0.02401518 11.11270406 2.23598825 0.13105547 -0.18680725 -0.10234132 Mg 4.46925639 8.89222279 0.00991467 -0.11075748 0.09179246 -0.12075494 Mg 6.68558316 11.04039854 0.00041749 -0.03581321 0.01230251 0.11015802 Mg 6.67955850 8.85702999 2.25761885 -0.05977406 0.06052725 -0.01823524 Mg 4.47384545 11.07988182 2.25832691 -0.03897135 0.14363252 -0.14176943 Mg 8.82656239 8.90356233 0.01992000 0.25289769 -0.07160822 -0.13179914 Mg 11.04366285 11.12977598 0.00739498 -0.25685699 -0.28415571 0.27434856 Mg 11.05262867 8.83957898 2.23867847 0.17670474 0.12693429 -0.13835874 Mg 8.88669990 11.07407196 2.24697342 0.03521642 0.19623561 -0.09764622 Mg 0.00223973 0.03502308 4.44202221 0.10438962 0.07566484 -0.06245861 Mg 2.25491586 2.22157119 4.43255923 -0.21381772 -0.04330822 -0.06336843 Mg 2.21710822 0.03280002 6.63812547 -0.07444689 -0.22100581 0.00137559 Mg 0.01496888 2.22773864 6.61147511 -0.21906281 -0.00651810 0.07208473 Mg 4.46535417 0.02735149 4.46115646 -0.08620415 -0.26791800 -0.11278497 Mg 6.61004686 2.20981922 4.42102617 0.15615887 0.08754225 0.06192796 Mg 6.63917815 0.00074272 6.65898861 0.05665920 -0.15882697 0.01961441 Mg 4.40336144 2.21466595 6.63287707 0.09839403 0.11515374 0.10905729 Mg 8.88782403 0.04249390 4.42773731 0.05934109 -0.18590389 0.03189892 Mg 11.09013041 2.23160268 4.47097980 0.11438769 -0.04824834 -0.06622351 Mg 11.04878479 0.02380495 6.69997097 0.01748304 0.05483025 -0.06750187 Mg 8.83453409 2.19167265 6.68347243 0.08957534 0.09286162 -0.11620028 Mg 0.00456979 4.40098966 4.39143733 -0.20006224 -0.01319428 0.00047048 Mg 2.18025099 6.63547197 4.46637199 0.12642564 0.05417694 -0.11575808 Mg 2.18736606 4.43012268 6.61895429 0.03807789 0.00313417 0.13458778 Mg 0.00616747 6.62804317 6.64644799 -0.22752702 0.04708229 0.03050203 Mg 4.39435058 4.42167712 4.40321019 0.10601798 0.12415350 0.10929961 Mg 6.61144160 6.65613815 4.44752078 0.11749781 -0.05407788 0.04891618 Mg 6.67418197 4.39208516 6.65431852 -0.08528400 0.06626700 -0.08392888 Mg 4.39535318 6.61693485 6.65221965 0.06215961 0.11458450 -0.02016301 Mg 8.88578328 4.43109698 4.41429167 -0.01800636 -0.09687649 0.10845172 Mg 11.10222398 6.61035078 4.42526685 0.15589039 0.05433205 -0.00788017 Mg 11.09604012 4.45354350 6.69049968 0.19016043 -0.10742572 -0.08278128 Mg 8.90521964 6.61564220 6.64943858 -0.09808715 0.12912010 -0.04351883 Mg 0.02487449 8.83615632 4.39442406 -0.17731691 0.12570577 0.05897718 Mg 2.19915665 11.06321087 4.39234761 -0.03502796 0.17615519 0.07345959 Mg 2.20272702 8.90379767 6.69245489 -0.04966868 -0.09723746 -0.13149175 Mg 0.03592339 11.05266438 6.69268536 0.01072983 -0.04379583 -0.08407893 Mg 4.38334940 8.83023959 4.41515765 0.07123576 0.01640237 0.08201993 Mg 6.64232637 11.06026885 4.46277969 -0.00209701 0.19399928 -0.02229591 Mg 6.68113586 8.84871714 6.61278537 -0.11332854 -0.01398568 0.13717290 Mg 4.39069982 11.04412471 6.64167249 0.05960637 0.22048656 -0.02049427 Mg 8.89719132 8.91712384 4.45970253 -0.00578512 -0.16835808 -0.03830219 Mg 11.09942886 11.10102851 4.42754759 -0.08407633 -0.08280953 0.00593110 Mg 11.08168594 8.86969965 6.61210158 0.17678176 0.01186717 0.09195003 Mg 8.85519519 11.09702119 6.66289246 0.08044509 0.18147742 -0.01547157 Mg 0.02339984 0.04104924 8.82655481 0.09687459 0.10314337 0.06220384 Mg 2.17929099 2.26298189 8.83584315 0.10430909 -0.13750124 0.15035878 Mg 2.19183937 0.03262387 11.06368126 0.03899658 0.15520863 -0.16695018 Mg 0.02187507 2.19216380 11.08709354 0.09934967 -0.01442475 -0.11907217 Mg 4.40891096 0.02140127 8.83648173 -0.04246248 -0.13416457 0.17112152 Mg 6.61268427 2.19010634 8.90286946 0.10349197 0.03820621 -0.04906842 Mg 6.64354113 0.01338052 11.09388689 0.01295271 0.06468395 -0.13001226 Mg 4.46108672 2.24172007 11.11307810 -0.10903003 -0.09055500 0.06510060 Mg 8.91143824 0.02859659 8.84361473 -0.07617629 -0.18773550 0.25134247 Mg 11.07711653 2.23882530 8.88818729 0.15898036 -0.05872266 0.12291694 Mg 11.10848847 0.00162157 11.06809241 -0.26365575 0.26174622 -0.24941885 Mg 8.84612604 2.20229091 11.12122703 0.19896401 -0.07368090 0.04100880 Mg 0.00537262 4.44339002 8.93740575 -0.18821974 0.01770279 -0.05770398 Mg 2.17263692 6.69608038 8.84974877 0.10922781 -0.14927600 0.11961540 Mg 2.22655877 4.40772026 11.06844090 -0.03906011 0.07930810 0.15802054 Mg 0.01928929 6.70254496 11.12064883 0.06679341 -0.07705874 -0.08031421 Mg 4.45360077 4.46290090 8.83767096 -0.10416821 -0.12437009 0.09469840 Mg 6.63829393 6.63609915 8.83953796 0.06729241 0.11303984 0.06715801 Mg 6.72150583 4.39917727 11.09641752 -0.09927575 0.10955543 0.08907378 Mg 4.43105694 6.63695542 11.07222201 0.01857146 0.05556367 0.09806916 Mg 8.89462265 4.43561943 8.82806908 -0.07640768 -0.06759967 0.25022755 Mg 11.09685951 6.62251674 8.91288839 0.15161687 0.12201085 -0.03014565 Mg 11.10969934 4.46516561 11.09567593 -0.19156507 -0.06595812 -0.09654666 Mg 8.84746351 6.68609820 11.06108921 0.05957943 -0.02034331 0.13534360 Mg 0.00252272 8.86997838 8.89732973 -0.21118831 0.07098470 0.02269641 Mg 2.18584421 11.12842574 8.88361391 0.03079190 0.08759978 0.13357076 Mg 2.17556908 8.86132847 11.10388202 0.12987562 0.11320114 0.10024880 Mg 0.03467778 11.04653828 11.09279526 0.16581740 -0.17403402 -0.18692743 Mg 4.42697132 8.89834650 8.84840531 0.02190314 -0.07817265 0.13629682 Mg 6.63155905 11.10193344 8.85740631 0.07627237 0.08659172 0.06753206 Mg 6.64449041 8.92720645 11.11324009 0.05883421 -0.02951445 0.01571890 Mg 4.44766393 11.07844382 11.08318933 -0.09059818 -0.08624107 -0.10289064 Mg 8.88597694 8.87802243 8.84531610 -0.04591463 0.03020334 0.11385348 Mg 11.04729161 11.07160454 8.83679404 -0.06981996 -0.09819148 0.05372686 Mg 11.08801583 8.87076801 11.04544249 -0.14084273 0.05126283 -0.10763453 Mg 8.92493121 11.11556824 11.09453355 -0.04276516 -0.21252628 -0.21495592