108 Lattice="13.277817281052247 0.0 0.0 0.0 13.277817281052247 0.0 0.0 0.0 13.277817281052247" Properties=species:S:1:pos:R:3:forces:R:3 energy=-137.83259368947324 stress="-0.0017031550493827082 0.0002207770566172931 9.97847776045707e-05 0.0002207770566172931 -0.00205849792464724 -5.3589692535655766e-05 9.97847776045707e-05 -5.3589692535655766e-05 -0.001854102222123464" pbc="F F F" Mg 0.03531952 0.07670798 0.02702481 -0.09332015 -0.08635942 -0.08842521 Mg 2.24838117 2.17688518 0.03668889 -0.12559935 0.31162005 -0.11945188 Mg 2.17019500 0.03134428 2.20892349 0.18151266 -0.15164824 0.06018207 Mg 0.01174976 2.25655112 2.17158959 -0.08189632 0.01088654 0.16905100 Mg 4.39600610 0.04360167 0.00890117 0.08416830 -0.15827767 -0.05576947 Mg 6.60948540 2.24356267 0.02988621 0.10419504 -0.05750820 -0.10791577 Mg 6.59673516 0.00839958 2.21983066 0.14295051 -0.04930839 -0.01899062 Mg 4.43485533 2.17521936 2.21016479 0.00375647 0.17277366 0.17691388 Mg 8.78771472 0.01205385 0.01090932 0.06398556 -0.01831825 0.00347297 Mg 11.05837167 2.17903753 0.03636629 -0.00984381 0.09256367 -0.07366944 Mg 11.03855449 0.03593020 2.25067014 0.00350613 -0.14822927 -0.04546729 Mg 8.87381802 2.18749578 2.17443218 -0.29013252 0.22641237 0.23174376 Mg 0.01170208 4.46991259 0.02651957 0.06819817 -0.11886111 -0.02873111 Mg 2.20723535 6.61801683 0.02357442 0.12815026 -0.03486555 -0.05955750 Mg 2.24809955 4.39007838 2.26989170 -0.07959919 0.13682408 -0.16956450 Mg 0.06884267 6.63276309 2.23378155 -0.10285686 -0.05584146 0.06685900 Mg 4.40356520 4.40031897 0.03971449 -0.08905710 0.06739215 -0.14824344 Mg 6.63360270 6.59581809 0.02539214 -0.03894372 0.24866297 -0.09282149 Mg 6.60668548 4.45937720 2.17379133 0.15291666 -0.25014156 0.24191302 Mg 4.43642691 6.62888367 2.22498885 -0.06550662 0.07010544 -0.06930696 Mg 8.85490650 4.46228830 0.02238516 0.05674589 -0.18910233 -0.10285119 Mg 11.09799723 6.60488870 0.02399199 0.04017002 0.07595459 -0.05728658 Mg 11.05041307 4.42789610 2.21681222 0.08956948 0.01119535 0.03579666 Mg 8.89097412 6.64621390 2.19550530 -0.07496515 0.08173051 0.14129516 Mg 0.07353914 8.86872117 0.02187067 -0.08371958 -0.03196665 -0.00119934 Mg 2.25715007 11.04894976 0.03853819 -0.05294011 0.06696761 -0.06467093 Mg 2.23639840 8.82499843 2.19667115 -0.02590007 0.18023524 0.15793425 Mg 0.02768116 11.09567206 2.21498378 0.08903978 -0.10078419 0.05982098 Mg 4.42067382 8.84071669 0.03642750 0.13460771 -0.11413008 -0.09692645 Mg 6.64551553 11.02975173 0.03455469 0.01378316 -0.00496803 -0.14239417 Mg 6.67891689 8.86920624 2.25564569 -0.08704895 -0.13471997 -0.18398260 Mg 4.45006031 11.04891975 2.16909702 -0.05346544 0.09767598 0.22014149 Mg 8.86409324 8.81048981 0.00090820 0.08037590 0.05820604 -0.03570533 Mg 11.09181416 11.10728016 0.00260309 -0.11747893 -0.18609055 0.10807316 Mg 11.10514539 8.82058600 2.23146370 -0.06414370 0.17280683 -0.08946774 Mg 8.84697263 11.02627253 2.16876483 0.16140310 0.03352831 0.24743102 Mg 0.04347699 0.03928290 4.41346738 -0.13242925 -0.02899768 -0.01446180 Mg 2.20605675 2.20287766 4.40385908 0.14064893 0.01272710 0.13802384 Mg 2.22304031 0.03372755 6.63159871 0.06801389 -0.04844922 0.06460977 Mg 0.01955972 2.17451499 6.67303921 -0.05801461 0.09079020 -0.13128437 Mg 4.43298646 0.01902423 4.41085488 -0.11027958 -0.10555176 0.07889418 Mg 6.63921020 2.20205203 4.46916038 0.08288954 0.15008825 -0.24507160 Mg 6.61476760 0.02987993 6.66272225 0.06815121 -0.14868961 -0.05240291 Mg 4.46144574 2.21210098 6.65966745 -0.24063470 0.07964194 -0.03618002 Mg 8.82812491 0.04101047 4.44815979 0.06005835 -0.07349859 -0.02819247 Mg 11.08023580 2.23470714 4.39831527 -0.06086370 0.01084946 0.08075574 Mg 11.08400359 0.03432287 6.62761110 -0.02908359 -0.09703005 -0.04710650 Mg 8.88013497 2.20545607 6.65764109 -0.09364509 0.11415697 -0.20805970 Mg 0.02953671 4.39393678 4.46599912 -0.13794501 0.09161629 -0.12482329 Mg 2.24551775 6.67628017 4.44948123 -0.09761284 -0.15638586 -0.05575732 Mg 2.18381813 4.41828282 6.60509761 0.26008292 -0.10567212 0.15312393 Mg 0.03004795 6.60735038 6.67581378 -0.10613944 0.12839509 -0.16201118 Mg 4.45035867 4.43790073 4.44025989 -0.02860265 -0.13022374 0.00050782 Mg 6.64254911 6.65641595 4.40793897 0.04482339 0.03250610 0.16336648 Mg 6.64487808 4.41872222 6.67147014 0.03490584 0.10803921 -0.14818277 Mg 4.43026475 6.63254813 6.64270373 0.03221500 0.06538145 -0.05648518 Mg 8.81823990 4.47776813 4.38805096 0.11119058 -0.20209828 0.08328919 Mg 11.09346921 6.68150270 4.46446964 -0.02120453 -0.14490718 -0.12118609 Mg 11.03628641 4.42117440 6.59888667 0.06015046 0.07243522 0.12136953 Mg 8.86788368 6.66206479 6.66646205 -0.09640620 -0.05952791 -0.08898482 Mg 0.02555859 8.84396129 4.41696648 -0.04644569 0.08890356 0.06664738 Mg 2.24178701 11.05343501 4.44620061 -0.02393065 0.08030488 -0.19594699 Mg 2.24788477 8.88627651 6.60286239 -0.13283774 -0.09078147 0.22631559 Mg 0.04110111 11.09853466 6.65957362 0.02343412 -0.07300458 -0.00998295 Mg 4.44481362 8.87508862 4.38616212 0.03060447 -0.00379019 0.14994789 Mg 6.59827076 11.09611750 4.45864223 0.18452799 0.08166896 -0.13557530 Mg 6.66433274 8.90611693 6.64234076 -0.13726933 -0.26327001 -0.04697627 Mg 4.44040849 11.06893391 6.65693444 -0.13418173 0.11884442 -0.07877359 Mg 8.86040142 8.86771868 4.46242588 0.03808940 0.04342768 -0.16299969 Mg 11.08927902 11.05440170 4.45487121 -0.10831869 -0.04655812 -0.05901776 Mg 11.04115350 8.82895011 6.65537741 0.14848679 0.15448954 0.04630892 Mg 8.84525088 11.04062716 6.67113963 0.12539886 0.13087716 -0.02775887 Mg 0.02676163 0.05678504 8.85440877 0.07786112 -0.08871554 0.09831171 Mg 2.24188134 2.24316600 8.88457719 -0.04381654 -0.13924503 -0.22878632 Mg 2.28295468 0.02248035 11.07512215 -0.10595321 -0.03204872 -0.04613357 Mg 0.03834093 2.18713014 11.08811495 -0.01261559 0.02047291 0.01138391 Mg 4.43894405 0.01643718 8.84281933 0.00616027 -0.02773971 0.06283799 Mg 6.67698919 2.24714706 8.85383197 -0.06456457 -0.18970190 0.14317878 Mg 6.60856608 0.01186662 11.10596755 0.05478323 0.08630615 -0.10107009 Mg 4.41297459 2.22913944 11.02261286 0.14736425 -0.08267097 0.16075967 Mg 8.81186084 0.03598662 8.83850406 0.07991215 -0.11389707 0.14052097 Mg 11.03898432 2.17541285 8.81556219 0.05217639 0.27598815 0.13652177 Mg 11.10394084 0.04109982 11.02510343 -0.06462463 -0.02909087 -0.04196276 Mg 8.89112385 2.20424058 11.10679709 -0.13934865 0.02430227 -0.10884910 Mg 0.02123418 4.37208889 8.83981077 -0.09248613 0.06001401 0.13698490 Mg 2.19971971 6.61297529 8.83971813 0.14020623 0.04559237 0.05613387 Mg 2.20792822 4.39019050 11.07044212 -0.04277270 0.19175763 0.07394248 Mg 0.02535146 6.65318044 11.02633793 -0.03548770 -0.12319067 0.03337128 Mg 4.43338928 4.42400786 8.88184936 -0.10074050 0.14015361 -0.12424948 Mg 6.60958651 6.66948089 8.83489602 0.05717665 -0.02781542 0.17841063 Mg 6.61943586 4.39057894 11.04280025 0.08277581 0.17689175 0.10153115 Mg 4.38175596 6.66835827 11.10349823 0.16775075 -0.15378532 -0.06891538 Mg 8.84050087 4.46193818 8.82702612 0.20619147 -0.10563028 0.18570515 Mg 11.08889587 6.68204256 8.87773454 0.04893977 -0.27988557 -0.10566451 Mg 11.05170796 4.41472598 11.07329449 0.03093141 -0.02816332 -0.12131897 Mg 8.86025720 6.60266077 11.04858184 -0.07289213 0.00613465 0.05566457 Mg 0.00910854 8.82781319 8.83479120 0.11968556 0.20139029 0.03785285 Mg 2.23822608 11.06946447 8.90041344 -0.14090159 -0.05589210 -0.11286322 Mg 2.23681113 8.81983370 11.09757249 -0.14677067 0.14841853 -0.11618690 Mg 0.01990013 11.07516594 11.08300151 0.07273133 -0.13237982 -0.08619218 Mg 4.41598888 8.86298873 8.82065748 -0.01736532 -0.11188199 0.16148454 Mg 6.59990204 11.07105364 8.81342320 0.19672967 -0.00345814 0.26513316 Mg 6.66985697 8.82277505 11.07821271 -0.07682852 0.12819723 -0.07191225 Mg 4.42584418 11.03047648 11.02825708 0.09968756 -0.00079205 0.11573831 Mg 8.87467216 8.84146790 8.87930773 -0.19386838 0.09393064 -0.07026005 Mg 11.09581616 11.03476161 8.85435706 -0.03102075 0.00864996 -0.05850219 Mg 11.04482898 8.83036526 11.02225031 0.04955358 0.05638138 0.16900976 Mg 8.87352323 11.07418659 11.03586146 -0.08900355 -0.03972460 -0.06577870