108 Lattice="13.303628357030119 0.0 0.0 0.0 13.303628357030119 0.0 0.0 0.0 13.303628357030119" Properties=species:S:1:pos:R:3:forces:R:3 energy=-138.26906301702607 stress="-0.0021567625612969434 -6.043468553828769e-05 -4.992804129640937e-05 -6.043468553828769e-05 -0.0022417107983709033 -2.445915286027059e-05 -4.992804129640937e-05 -2.445915286027059e-05 -0.0021132484609980746" free_energy=-138.26906301702607 pbc="F F F" Mg 0.02176164 0.00043999 0.01084651 0.25745658 0.23472746 0.24820955 Mg 2.25129622 2.19478591 0.01333244 -0.23592330 0.02889569 -0.14505984 Mg 2.24757548 0.00567346 2.22815934 -0.09826615 -0.22447798 -0.08209703 Mg 0.03697061 2.16499255 2.24635095 -0.15929582 0.09306193 -0.16572208 Mg 4.39991284 0.02543275 0.00170320 0.08430796 0.03052559 0.06092353 Mg 6.66644898 2.22235942 0.00649731 -0.03751971 -0.08647386 -0.19025373 Mg 6.68757752 0.00000886 2.18930835 -0.16423322 -0.14006050 0.06010579 Mg 4.42388056 2.21643725 2.19594106 0.08664580 -0.04920344 0.13505864 Mg 8.83921222 0.04321185 0.03886596 0.13720396 -0.02122063 -0.02735873 Mg 11.06473165 2.21015158 0.02020753 -0.09590563 0.02556578 0.10565529 Mg 11.11005315 0.01525689 2.21817099 -0.15174989 0.09080219 -0.02189707 Mg 8.89794106 2.16422532 2.17834577 -0.02328711 0.17755140 0.14541421 Mg 0.01938364 4.47042882 0.03519868 0.12231133 -0.08806611 0.13108844 Mg 2.20347285 6.68537825 0.04376740 -0.03138863 -0.10878576 -0.26541053 Mg 2.21230801 4.44947927 2.25784530 0.02713496 -0.13537946 -0.17186568 Mg 0.04208220 6.67874689 2.24560097 -0.26813402 -0.04131168 -0.09530636 Mg 4.45767035 4.37706267 0.00395641 -0.15044255 0.12908413 -0.18745146 Mg 6.60862833 6.62882866 0.01281490 0.05405373 0.06722799 -0.18287172 Mg 6.60811689 4.42081289 2.20981028 0.13245055 -0.00456072 0.11565515 Mg 4.39622885 6.67901229 2.18635966 0.16133113 -0.15646277 0.11437678 Mg 8.82595609 4.44350224 0.00122376 0.19847899 0.02900520 -0.04501700 Mg 11.12901759 6.65411987 0.03585145 -0.20426663 -0.02826925 0.11038589 Mg 11.12145219 4.43360456 2.24965955 0.07482319 0.03805708 -0.17956705 Mg 8.84010877 6.67860495 2.24213689 0.11297246 -0.10105208 -0.13890398 Mg 0.03920299 8.90335975 0.02182199 0.10635169 0.03384896 0.17431431 Mg 2.23359467 11.05982315 0.02824780 -0.10114897 -0.08341113 0.11756654 Mg 2.23996613 8.83532335 2.25737599 -0.14622638 0.30660077 -0.07623319 Mg 0.01530152 11.11775194 2.25292627 0.18050450 -0.22628451 -0.04758672 Mg 4.39767760 8.87407840 0.02600733 0.09998800 0.08896042 -0.21184050 Mg 6.62138093 11.10436333 0.02511562 0.05465559 -0.14768598 0.12584313 Mg 6.64024219 8.82511707 2.23323750 -0.06440044 0.19036432 -0.09161262 Mg 4.41249331 11.12309735 2.17882197 0.04696529 0.08035448 0.09248235 Mg 8.83493130 8.87645491 0.02179008 0.11846042 0.04531825 -0.13267204 Mg 11.06834983 11.09625040 0.02399009 -0.26033649 -0.27557519 0.27116199 Mg 11.09974794 8.82873427 2.20532078 0.08713631 0.13372566 -0.07572336 Mg 8.87408746 11.05092957 2.25759087 0.02001525 0.14844711 -0.19723191 Mg 0.01557442 0.02137806 4.40865552 0.10793464 0.05002678 0.08586257 Mg 2.25214607 2.20847147 4.41342188 -0.04035226 0.04887757 0.11343503 Mg 2.25786122 0.03577750 6.65877761 -0.14957429 -0.22129690 -0.06076433 Mg 0.02255753 2.21453149 6.68503305 -0.16830964 -0.05938704 -0.11013375 Mg 4.42711434 0.00386523 4.46734496 0.07330712 -0.17548885 -0.10147664 Mg 6.63650225 2.18350440 4.47363586 0.07803564 0.13434999 -0.17064689 Mg 6.64192129 0.01257521 6.68330401 0.04747850 -0.23685090 -0.00780630 Mg 4.47894058 2.21194165 6.69847177 -0.15334763 0.10329038 -0.13526142 Mg 8.84502229 0.00481108 4.45543070 0.15469496 -0.14306652 -0.01112134 Mg 11.09913508 2.20327191 4.40180642 0.12256602 -0.05678598 0.07016655 Mg 11.12305063 0.03225900 6.68488090 -0.14158087 0.11746181 -0.03379150 Mg 8.90041811 2.24549037 6.63310161 -0.08843167 -0.08526970 -0.02441338 Mg 0.01222645 4.45322202 4.46436014 -0.19297474 -0.09104636 -0.06959729 Mg 2.26789498 6.60766487 4.40132946 -0.05628172 0.13326144 0.16973100 Mg 2.21441808 4.41389307 6.62327552 0.10353883 0.04973173 0.16798018 Mg 0.02415362 6.67829468 6.64050537 -0.17212336 -0.09218685 0.15203035 Mg 4.47572692 4.46764429 4.47454545 -0.13348468 -0.19494877 -0.15238319 Mg 6.62016567 6.63873659 4.45439788 0.10268986 0.09358576 -0.10218777 Mg 6.62078879 4.47311032 6.63208575 0.20474308 -0.12043808 0.10325138 Mg 4.44268577 6.70618584 6.62737533 -0.10544020 -0.08797122 0.17608264 Mg 8.89804687 4.44444778 4.36314532 -0.14661085 -0.09429206 0.11843245 Mg 11.07502155 6.69333187 4.45884774 0.18980616 -0.05407768 -0.07163184 Mg 11.04206544 4.44030140 6.67672375 0.27681424 -0.02161516 -0.09351184 Mg 8.88739549 6.64415926 6.63076500 -0.06125352 0.02369928 0.08251588 Mg 0.03074234 8.82783303 4.44851847 -0.19784505 0.17023788 -0.07441865 Mg 2.20003938 11.08714173 4.43927003 -0.01437039 0.13176432 -0.01259419 Mg 2.18463414 8.82609845 6.63829432 0.07884152 0.16695555 0.11652576 Mg 0.00065182 11.07729346 6.63085340 0.11842344 -0.13521549 0.06044359 Mg 4.44466321 8.90489924 4.43447566 -0.03273359 -0.07563449 -0.03345193 Mg 6.66506026 11.05235845 4.45180054 -0.07052804 0.24748177 -0.09356813 Mg 6.68803322 8.87209564 6.67894945 -0.04188786 -0.07865100 -0.12351799 Mg 4.44313115 11.04989643 6.63821218 -0.06085073 0.20841906 0.02882074 Mg 8.82629849 8.87338874 4.44389809 0.17673390 -0.06375937 -0.03166605 Mg 11.08530533 11.05747107 4.36396331 -0.06423655 -0.11870046 0.07776025 Mg 11.08540722 8.85545334 6.66422290 0.11876267 0.14640295 0.05069288 Mg 8.87461397 11.05084765 6.62118738 0.19592797 0.21302223 0.08692818 Mg 0.03948304 0.02028238 8.85222881 0.09361019 0.08392218 0.09031660 Mg 2.22501571 2.17360897 8.86461354 -0.08690469 0.14981365 0.10557675 Mg 2.21692731 0.01010140 11.09555833 -0.05541315 0.14397362 -0.11985510 Mg 0.01502068 2.24217521 11.08624268 0.14096970 -0.11193478 -0.11532270 Mg 4.40189086 0.04153063 8.88728114 0.08209737 -0.28548398 0.11584688 Mg 6.64648343 2.19273788 8.86403085 0.11378081 0.14033195 0.11591599 Mg 6.66709101 0.03937309 11.06807236 -0.03372992 0.07001034 -0.06237899 Mg 4.39530375 2.26114605 11.07796495 0.07304260 -0.11636410 0.20435512 Mg 8.86459422 0.02917709 8.85091204 0.12391566 -0.18248962 0.08856277 Mg 11.04843221 2.22583781 8.90102047 0.24172747 -0.08600448 0.05560998 Mg 11.06952049 0.01617355 11.12117948 -0.22899808 0.21282557 -0.26182461 Mg 8.90147356 2.18815755 11.10358440 -0.02766678 0.02654999 0.13743081 Mg 0.01609092 4.39566047 8.90541061 -0.18291259 0.03650575 -0.13069001 Mg 2.21039819 6.63726194 8.91182646 0.13039033 0.08436558 -0.19233409 Mg 2.19535954 4.45150114 11.05000200 0.08954056 -0.07386856 0.25198219 Mg 0.04518840 6.62500820 11.04049139 -0.11374861 0.02498962 0.06109045 Mg 4.46026147 4.41508689 8.88215333 -0.05147477 0.16369816 -0.05116468 Mg 6.67649278 6.68457387 8.83428137 -0.06249576 -0.15725109 0.08142140 Mg 6.66972108 4.45016350 11.12545661 0.00513246 -0.07856822 0.03976586 Mg 4.47454026 6.68953541 11.10899771 -0.09606029 -0.06547798 0.06623036 Mg 8.86963044 4.40698262 8.84959988 -0.09200484 0.06645647 0.11574017 Mg 11.11950498 6.64696049 8.88613120 0.07377316 0.03779198 0.02997604 Mg 11.05778581 4.45970532 11.09904217 -0.06769598 -0.05629732 -0.08730616 Mg 8.86471232 6.62314502 11.04285891 0.06547607 0.11179453 0.19048021 Mg 0.01483746 8.91157990 8.95232930 -0.13421386 0.06896031 -0.12054843 Mg 2.24486928 11.10397588 8.86268345 -0.14476611 0.03980526 0.05130991 Mg 2.15853569 8.84229160 11.12592675 0.14384100 0.16670312 0.08876442 Mg 0.03049573 11.10226694 11.12985620 0.26101405 -0.21221678 -0.24213409 Mg 4.47496801 8.89287738 8.84802606 -0.25374542 -0.04594616 0.12061075 Mg 6.68883721 11.04869859 8.82739665 -0.05479193 0.29622014 0.16945515 Mg 6.62332233 8.87736898 11.05726217 0.06616015 0.08476355 0.22604492 Mg 4.37259143 11.09475024 11.07719629 0.04502172 -0.14891429 -0.11663487 Mg 8.86429710 8.87421078 8.90376712 0.22287962 0.04712230 -0.03523020 Mg 11.11396580 11.09994859 8.90610543 -0.24650310 -0.18980287 -0.02210643 Mg 11.08236142 8.91041950 11.05910744 -0.14021538 -0.02392446 -0.11252160 Mg 8.83798075 11.05616817 11.10848481 0.07216463 -0.10778834 -0.15970875