108 Lattice="13.303628635534272 0.0 0.0 0.0 13.303628635534272 0.0 0.0 0.0 13.303628635534272" Properties=species:S:1:pos:R:3:forces:R:3 energy=-138.32248593631684 stress="-0.0018739563101051293 -1.222250823838969e-06 -1.1739816962936991e-05 -1.222250823838969e-06 -0.001874540611265785 0.00011340675060175743 -1.1739816962936991e-05 0.00011340675060175743 -0.0018736748340142354" free_energy=-138.32248593631684 pbc="F F F" Mg 0.04244112 0.03291611 0.00305092 0.19654959 0.18586929 0.19481082 Mg 2.24040175 2.19554530 0.00229754 -0.02685336 -0.04884861 -0.18729168 Mg 2.20622286 0.02879251 2.23606587 -0.09025345 -0.16243724 -0.06689022 Mg 0.02952845 2.24006397 2.15536444 -0.17624190 -0.16561217 0.15745177 Mg 4.43132399 0.06106023 0.02005085 0.04362330 -0.00934160 0.05038646 Mg 6.69480624 2.23309181 0.02054068 -0.10429959 -0.10774189 -0.25787929 Mg 6.68838556 0.00100526 2.21883173 -0.07121322 -0.20488883 -0.02672071 Mg 4.46397918 2.17689277 2.23444679 -0.08241011 0.08665410 -0.11163411 Mg 8.83285342 0.03240010 0.03736424 0.18414140 0.11545902 0.10209291 Mg 11.12335436 2.24127456 0.00906166 -0.23331482 -0.03951032 0.21003050 Mg 11.13011493 0.03194137 2.22310503 -0.23332240 0.14826733 -0.08524444 Mg 8.84443919 2.24300233 2.21376347 0.31129261 -0.13919995 -0.01559461 Mg 0.07233026 4.38438121 0.03702468 -0.06230679 0.10923979 -0.09901735 Mg 2.24715179 6.62075492 0.00792223 -0.03366499 0.13312178 -0.19493813 Mg 2.20877833 4.44423613 2.17467794 0.04605372 -0.10299835 0.15618203 Mg 0.03734658 6.68352546 2.20584247 -0.23903064 -0.13899167 -0.04666366 Mg 4.43022074 4.40341829 0.02936308 0.05841528 0.01578187 -0.19517039 Mg 6.64025717 6.69411804 0.00547047 0.03528225 -0.08210751 -0.11132375 Mg 6.67193022 4.39779529 2.17918375 -0.05921533 0.15835047 0.12564930 Mg 4.42954964 6.61475002 2.26086736 0.05919817 0.11835318 -0.18230478 Mg 8.85867457 4.44366757 0.00223153 0.13808841 -0.01204677 -0.21131520 Mg 11.08928103 6.62482570 0.01660745 -0.06486900 0.05068915 0.07654688 Mg 11.07889919 4.45261118 2.23235797 0.12702032 -0.07520016 -0.02245981 Mg 8.88910517 6.63524210 2.18692737 -0.04960064 0.07513402 0.13356638 Mg 0.01376619 8.84494529 0.00643839 0.16551513 0.09599527 0.13500219 Mg 2.21934811 11.08722287 0.03033055 -0.03606066 -0.19998920 0.16327854 Mg 2.18427170 8.84324856 2.22899052 0.08044753 0.14087508 -0.17424723 Mg 0.00131581 11.11399873 2.21208823 0.14254631 -0.21597215 -0.04937709 Mg 4.47763586 8.86341047 0.00391217 -0.16795952 0.07250216 -0.09792564 Mg 6.69142139 11.06480713 0.01838198 -0.02069511 -0.04505244 0.04797916 Mg 6.64737789 8.90894717 2.22108745 0.06550534 -0.14309170 0.05264813 Mg 4.42649881 11.04689601 2.23003501 0.00973828 0.18765403 -0.05923929 Mg 8.90297168 8.87585704 0.02430912 0.06077403 0.06749690 -0.12703590 Mg 11.04891749 11.12236717 0.01811031 -0.24488453 -0.24852462 0.26205068 Mg 11.09045376 8.88575639 2.24167086 0.14275984 0.09234978 -0.15955494 Mg 8.84274934 11.10891052 2.24197696 0.16651652 0.14813675 -0.10713265 Mg 0.00504405 0.03842126 4.44521407 0.08931290 0.14009938 -0.04651751 Mg 2.24388017 2.25999184 4.46931848 -0.20072268 -0.15246399 -0.24593202 Mg 2.20565448 0.01499039 6.62254391 -0.04820027 -0.17136570 0.06355813 Mg 0.03840954 2.25503798 6.66009674 -0.19034638 -0.10563330 0.04384302 Mg 4.39158284 0.03632823 4.41477021 0.08864854 -0.24854147 0.03555880 Mg 6.67103263 2.19341640 4.41199381 -0.07493617 0.09500561 0.11686380 Mg 6.63069671 0.00145853 6.60777444 0.00683189 -0.10789803 0.13147477 Mg 4.40145850 2.24509618 6.63218700 0.21682697 -0.09534200 0.10465932 Mg 8.86435433 0.00349758 4.44878388 0.13249679 -0.15063520 -0.08830367 Mg 11.12442584 2.17716668 4.39308449 0.05597397 0.08714221 0.05597574 Mg 11.07641849 0.01932643 6.62017148 -0.07862845 0.09636372 0.08401090 Mg 8.89067549 2.22387468 6.63840829 -0.00892389 -0.05508557 0.07303144 Mg 0.02481855 4.41251694 4.43544361 -0.18393493 0.08491166 -0.05018618 Mg 2.23435376 6.62469380 4.43514028 -0.07674200 0.03705645 0.05803103 Mg 2.25638112 4.42497609 6.62394010 -0.09378376 0.13951882 0.19182570 Mg 0.02116697 6.68695480 6.68367139 -0.14592303 -0.06957491 -0.07239315 Mg 4.41192001 4.38747313 4.36580840 0.17823292 0.11060194 0.15927859 Mg 6.64718577 6.61060611 4.41888819 0.02502914 0.14387575 -0.05925240 Mg 6.66638134 4.47449599 6.65030803 -0.19448351 -0.23637393 -0.03754010 Mg 4.42949893 6.67588041 6.65225986 -0.02954803 -0.08143749 0.00891432 Mg 8.83050977 4.41435900 4.47179159 0.24421087 0.05047665 -0.13003682 Mg 11.12996256 6.69428512 4.43203567 0.03183675 -0.11302142 0.03785841 Mg 11.12072075 4.43141353 6.69585133 0.07253341 0.01989532 -0.11678368 Mg 8.83446434 6.64175630 6.63557681 0.24370481 0.14329699 0.03871362 Mg 0.00533333 8.82717976 4.41672943 -0.13351396 0.16096782 0.06962350 Mg 2.19057845 11.08365360 4.38437928 -0.00303752 0.10277764 0.09051169 Mg 2.22944703 8.89770800 6.69396789 -0.02580990 0.05409581 -0.16793085 Mg 0.00187371 11.11618996 6.58685227 0.13437127 -0.16150555 0.04983341 Mg 4.41082695 8.82683218 4.42057809 0.08081862 0.15919062 0.09222584 Mg 6.69223037 11.08905529 4.47353596 -0.16519186 0.10312025 -0.05973135 Mg 6.66530072 8.82866592 6.68871992 -0.06321458 0.09286779 -0.11789605 Mg 4.44428980 11.11414980 6.65116942 -0.04663848 0.05273270 -0.06129378 Mg 8.90234931 8.89885074 4.41306161 -0.08246539 -0.16445965 0.05042584 Mg 11.07247003 11.08481029 4.46047654 -0.05099270 -0.05732751 -0.03165567 Mg 11.11402986 8.86421232 6.66165411 0.03134499 0.07621742 0.10849691 Mg 8.84486184 11.06428516 6.62347134 0.19236211 0.13590425 0.20545582 Mg 0.02337906 0.02928598 8.86243821 0.06592498 0.09608058 0.00900481 Mg 2.22011678 2.17110591 8.91079761 -0.08514896 0.15475710 -0.07544995 Mg 2.17790610 0.02802163 11.06309327 0.04295394 0.04934978 -0.02429270 Mg 0.01604218 2.18342281 11.12399409 0.08709771 0.03237375 -0.17636340 Mg 4.39113200 0.01071755 8.86917852 0.10634065 -0.15749980 0.01972658 Mg 6.67789682 2.17902152 8.89027007 -0.06468033 0.06931005 -0.18077527 Mg 6.69547057 0.01216555 11.05629027 -0.08232367 0.02392993 -0.02568605 Mg 4.46376167 2.24155303 11.06573890 -0.06730878 -0.11145778 0.18982088 Mg 8.88358896 0.00569338 8.89748756 0.10225997 -0.21408229 -0.11727442 Mg 11.05687253 2.24169495 8.90381155 0.19645496 -0.09576529 -0.04616706 Mg 11.11513822 0.01606959 11.07343465 -0.21945738 0.20628802 -0.21987109 Mg 8.89908303 2.17560143 11.04241185 0.00660519 0.11164228 0.26729022 Mg 0.02722081 4.45013625 8.86662213 -0.13515835 -0.04504267 0.08856452 Mg 2.18805772 6.69299772 8.88115702 0.12974936 -0.12369842 0.03349525 Mg 2.17551718 4.41696253 11.08191062 0.04200228 0.03852833 0.11470928 Mg 0.02347494 6.70871315 11.10195835 0.09547329 -0.00753438 -0.10813120 Mg 4.44137276 4.41043926 8.83507080 -0.11647679 0.04642232 0.06648485 Mg 6.61770414 6.61972823 8.87539800 0.05899456 0.15370993 -0.02316369 Mg 6.63429567 4.45179894 11.04429944 0.07463224 -0.08683157 0.23668688 Mg 4.42513954 6.66320018 11.06424295 -0.07931172 -0.05720098 0.17942636 Mg 8.82691007 4.48027823 8.83279846 0.17229305 -0.15483113 0.09688210 Mg 11.12717642 6.64362406 8.91097208 0.04760081 0.07522089 -0.07656235 Mg 11.05861581 4.45823924 11.06971295 -0.04975217 -0.08016952 -0.04664336 Mg 8.88733245 6.61014520 11.07906508 -0.03098421 0.10899656 0.15357275 Mg 0.04044187 8.90638320 8.87560834 -0.23090185 0.11309484 0.06544480 Mg 2.21645507 11.11012205 8.86717333 -0.07561022 0.17181527 0.04541723 Mg 2.24779855 8.91603124 11.08833282 -0.17877530 -0.03138581 0.17146156 Mg 0.00623457 11.06779337 11.09176593 0.23836833 -0.21684699 -0.22261738 Mg 4.44979043 8.89352733 8.90411660 -0.05274411 -0.01283751 -0.14037766 Mg 6.62670688 11.11434669 8.84857436 0.10045655 0.11578925 0.13925140 Mg 6.65637244 8.85166541 11.04864411 0.07749492 0.10733527 0.22065694 Mg 4.40214138 11.02759682 11.09799092 0.08889659 0.05665834 -0.04456513 Mg 8.85471760 8.88177354 8.90361602 0.17202455 0.05145977 -0.04029353 Mg 11.12781853 11.10651963 8.93866911 -0.25966944 -0.24083712 -0.05284913 Mg 11.04507850 8.85470112 11.09488925 -0.09916164 0.05954982 -0.11852183 Mg 8.91615872 11.09953237 11.12035462 -0.04292940 -0.18211865 -0.22172339