108 Lattice="11.80414339798603 0.0 0.0 0.0 11.80414339798603 0.0 0.0 0.0 11.80414339798603" Properties=species:S:1:pos:R:3:forces:R:3 energy=-237.93043958562475 stress="-1.3313948613205469 0.9003921442925655 -7.038824757149179 0.9003921442925655 -1.8931852311277524 3.9702435027467864 -7.038824757149179 3.9702435027467864 -5.780125039963141" pbc="F F F" Mg -0.02079033 -0.01071789 0.04324936 0.41984235 -0.13027508 -0.12693134 Cu 1.95086665 1.98415942 -0.01213582 0.26031799 -0.29020122 0.43910805 Cu 1.97413961 -0.01735870 1.92918925 0.27282124 0.58986197 -0.07634219 Mg 0.01602860 1.95907167 1.94592259 -0.82555472 -0.25886447 -0.02390478 Cu 3.88376764 0.00269687 -0.02220037 0.08144904 0.96246568 0.86081940 Mg 5.86461055 1.99658014 0.00720566 0.08980328 -1.59121525 -0.49629684 Cu 5.89422035 0.00083619 1.96707251 -0.06443014 0.76402559 -0.03240661 Cu 3.96430296 1.95488368 1.95975474 -0.07947927 -0.31006013 0.04711932 Cu 7.86097571 0.00944402 0.00139667 -0.05467487 0.64755419 0.69081281 Mg 9.79182570 1.95014800 0.00898625 0.17440860 -0.70644526 -0.64225871 Cu 9.81958472 0.00401688 1.98097629 -0.63124602 0.58890995 -0.00069890 Mg 7.88131198 1.94878477 1.99951265 -0.97642359 -1.49825974 0.17005656 Mg -0.01295103 3.98504670 -0.01808936 -0.32389342 -0.18805398 -1.33692304 Cu 1.94808493 5.93475895 0.00473749 0.07203235 0.09470815 0.22360299 Mg 1.93486056 3.90957058 1.92386080 0.94150714 -0.42324470 0.15297661 Mg 0.01784854 5.89456466 1.94896199 -0.91166943 0.31671127 0.10037977 Mg 3.96727633 3.96954633 -0.01447183 -1.30508063 -0.73618935 -1.30899558 Mg 5.91245610 5.88013087 0.01416340 1.80034282 0.93631608 -0.90360035 Mg 5.92218733 3.97324113 2.00316588 0.53759404 -0.76765966 0.95020861 Mg 3.91653534 5.91747355 1.92870149 -0.45304926 0.98207077 0.95211655 Cu 7.92764650 3.91680475 0.01000341 -0.08606663 0.28538856 0.31300246 Cu 9.85178618 5.88637552 0.00550524 -0.82917838 -0.03932051 0.89253123 Mg 9.79937505 3.91729236 1.95384047 0.40996239 2.01680047 -0.11000333 Cu 7.85592716 5.96525045 1.98357711 0.35494702 -0.03384927 -0.22528283 Mg -0.00574554 7.88608100 -0.02191567 0.52285677 0.75501165 0.12756459 Cu 1.95091322 9.82843148 -0.02049112 -0.01043425 -0.82777242 0.76928363 Cu 1.92012768 7.86987723 1.95783746 0.17520587 0.45192871 -0.00245669 Cu -0.03461722 9.80906937 1.98811788 0.74431173 -0.77733806 -0.04066969 Mg 3.92811525 7.89422129 0.04348192 -0.42703126 1.47243435 -0.23679082 Cu 5.92034270 9.81832462 0.02855696 0.00844539 -0.71631244 0.72339932 Cu 5.91519619 7.89626306 2.00029277 -0.10672283 0.05037901 -0.22561518 Cu 3.94700235 9.84346253 1.94927452 -0.00550473 -0.73473085 0.00110798 Cu 7.88954396 7.85789637 -0.03319952 0.07099018 -0.01922331 0.74781401 Mg 9.83886284 9.83323510 -0.00377565 -0.07956109 -0.55305208 0.09326224 Cu 9.87406988 7.81910845 1.95683103 -0.71681529 -0.03418210 -0.07995335 Mg 7.88088674 9.82264645 1.96233105 0.29123247 0.05499008 -0.73207083 Mg 0.03735984 -0.02156823 3.95888117 -0.76471771 -0.65383586 -0.30125310 Mg 1.99508596 1.96822425 3.92603627 1.06728400 0.34302139 0.30086464 Mg 1.93465527 0.01495032 5.91378544 0.98546320 -0.86931236 -0.65923473 Cu 0.03428684 1.96940288 5.87108977 0.24966053 0.27711523 -0.03589142 Cu 3.94667404 0.01153518 3.92123168 0.03247879 0.71265127 -0.03276388 Cu 5.88768328 1.98990918 3.87347232 -0.12146049 -0.21101708 0.22137352 Cu 5.90546365 -0.00216970 5.87446936 -0.11527657 0.59018875 -0.13829148 Cu 3.90432081 1.97402143 5.83436634 0.37978883 0.02271337 -0.00536801 Cu 7.83484965 -0.02582322 3.93133230 -0.04958114 0.63125019 0.00204009 Mg 9.80132661 1.95338645 3.92932295 0.87990066 -0.72540468 0.59191277 Cu 9.84793332 0.03347319 5.88023429 -0.48948941 0.39884947 -0.00973774 Mg 7.86334449 1.96103821 5.92715504 -0.58329302 -0.05274114 -1.93487995 Cu 0.00023868 3.91220312 3.90348392 0.36096671 0.01394741 0.22306629 Mg 1.99581317 5.89395999 3.93282734 0.79038473 -0.59563457 0.56452379 Cu 1.95327472 3.92668712 5.91837944 0.10576944 -0.01040118 -0.25328714 Mg -0.02818386 5.94002469 5.95098154 -1.22752941 -0.68887439 -0.18576010 Cu 3.93963587 3.90866194 3.95032839 0.10346919 -0.03498506 0.13973627 Mg 5.93105014 5.91851730 3.96431111 -0.84512160 -0.72826299 -0.27101339 Cu 5.91763480 3.96553587 5.92874347 -0.25636878 -0.07761857 -0.26758753 Cu 3.98875137 5.92544192 5.88849473 -0.03783986 -0.25132456 0.00808864 Cu 7.88180001 3.89584484 3.92517764 -0.07825909 0.27024098 0.20056470 Cu 9.86052884 5.93095232 3.96332190 -0.62310495 -0.04439633 -0.06835884 Cu 9.79763331 3.90651878 5.89372382 -0.31383141 0.16463869 -0.06330820 Mg 7.88887062 5.87887299 5.88513000 1.14010324 -0.77705383 0.03845276 Mg -0.00663316 7.89133745 3.92866679 -0.63889550 1.18286426 -1.09961234 Cu 2.01867654 9.86088376 3.94909471 0.01738679 -0.69093030 -0.09014609 Mg 1.97601368 7.86763596 5.88531222 1.12788455 0.70349269 -0.59392358 Mg -0.00492887 9.86784377 5.93245461 -0.71417621 0.63642017 -0.30943677 Cu 3.94012915 7.85376104 3.94516598 -0.08318494 0.29967195 -0.19982777 Mg 5.93242518 9.86038948 3.95079275 -1.09997583 0.83937618 -0.21078229 Mg 5.90652925 7.90458308 5.87301552 -0.95650138 -0.17651476 0.25583717 Cu 3.97083592 9.87480884 5.93294057 -0.20682176 -0.40808772 -0.20961761 Mg 7.87771716 7.84530871 3.91538545 2.08199486 0.37500643 -0.48493009 Cu 9.81101756 9.86140789 3.92525325 -0.79742736 -0.78945543 -0.07333975 Cu 9.81271237 7.87531238 5.88490068 -0.54103985 0.13129489 0.02456821 Cu 7.85061062 9.80695457 5.95976494 0.42647101 -0.32815646 -0.12546958 Mg 0.01131739 0.02869331 7.84063993 -1.40998411 -0.19494012 0.15378006 Mg 1.99588169 1.97872046 7.86601159 -0.81489090 1.04883117 -0.66378979 Mg 1.93135006 0.03433329 9.84245107 -0.64036693 -0.87482230 1.34490280 Cu 0.03306201 1.96524642 9.84055863 0.42839240 0.09757616 -0.41855177 Mg 3.93035179 -0.03672057 7.89937382 0.62104879 -1.29239064 -1.33910151 Mg 5.92085581 2.00052212 7.89434202 -0.40743691 0.21842367 -0.72362351 Mg 5.90502269 0.01748078 9.83811374 0.54210899 -0.81297883 1.30008300 Mg 3.88635203 1.95524337 9.81864231 0.28656168 1.16346688 2.09543921 Mg 7.87693953 0.01117298 7.83580163 -0.05411888 -1.55362415 -0.44237299 Mg 9.83632304 1.94835221 7.88915937 1.27198563 0.77782697 0.00846881 Mg 9.84707561 -0.00995974 9.79881046 0.16857925 -0.23839555 0.71391295 Cu 7.80917254 1.94348420 9.82721757 0.21781410 0.25873479 -0.19880117 Mg -0.00123190 3.91669424 7.90062872 -0.67546576 -0.27451761 0.64606791 Mg 1.98303324 5.91652988 7.86960264 -0.33238126 -0.20602160 1.21851319 Cu 1.95216472 3.90347866 9.85981629 -0.10029005 0.18129984 -0.37265564 Cu 0.01087557 5.95685961 9.82362628 0.71310307 -0.03241776 -0.78477331 Mg 3.92227324 3.93310765 7.87622642 0.66919670 1.23199695 -0.55742451 Cu 5.92593985 5.93649221 7.93248802 -0.26841987 -0.30943892 -0.22343019 Cu 5.89192801 3.86793594 9.85942540 -0.00085683 0.21361226 -0.34389557 Cu 3.88070195 5.94119947 9.80767084 0.07363682 -0.21079759 -0.26225821 Mg 7.82770372 3.95290492 7.87366719 0.42670695 0.48671405 0.65572617 Cu 9.80177404 5.94108143 7.82994746 -0.20938593 -0.19563728 -0.05276508 Cu 9.80565918 3.86277102 9.82853962 -0.57500115 0.03308050 -0.55244954 Mg 7.90309592 5.88154318 9.85373059 0.02292697 -1.02057229 0.86275744 Cu 0.00300338 7.86873960 7.83929347 0.30542933 -0.03600551 0.36337269 Mg 1.93481386 9.83090404 7.83412577 0.63123396 0.70244201 1.02080637 Cu 1.94648025 7.82995884 9.80611125 -0.08550732 0.07375174 -0.41076747 Mg -0.02100291 9.84738718 9.84686082 0.10600542 -0.45637583 -0.06649907 Mg 3.94596401 7.83846435 7.89990138 -0.17459189 -0.13546572 0.36108785 Mg 5.89305456 9.82629182 7.85698342 0.03112046 1.83540948 0.31354811 Mg 5.87883759 7.86477522 9.84510159 -0.36963726 0.14756071 1.43168426 Cu 3.88189642 9.87533306 9.83860233 -0.01332204 -0.61069355 -0.57944852 Mg 7.88197488 7.85881349 7.88351929 1.15087479 0.81777946 -0.60559235 Cu 9.85515665 9.87142830 7.86429379 -0.83235138 -0.89276313 0.04425082 Mg 9.84510811 7.85853097 9.79873006 0.67830937 0.75780651 0.03052709 Cu 7.86612208 9.82162622 9.82666360 0.07260870 -0.51049738 -0.56790106