108 Lattice="10.893287115708171 0.0 0.0 0.0 10.893287115708171 0.0 0.0 0.0 10.893287115708171" Properties=species:S:1:pos:R:3:forces:R:3 energy=-469.60038580596387 stress="-0.02392959882984367 0.012947400604705348 -0.006918289488370412 0.012947400604705348 -0.006320757713433302 -0.0033167947348832437 -0.006918289488370412 -0.0033167947348832437 -0.007585940005714112" pbc="F F F" Pd 0.00647260 0.03617714 0.05659864 -2.35975652 -0.96140818 -0.66031740 Pd 1.83766310 1.82328140 0.03126537 -0.58094844 1.20835128 -4.54075558 Pd 1.79994753 0.02449702 1.80167721 0.30167615 -4.12848421 2.62836485 Mn 0.00244494 1.78677293 1.78899157 0.70060597 4.00253177 0.74628270 Mn 3.59834540 0.01391899 0.02374229 3.37296233 -1.37089374 -0.65081331 Al 5.44083299 1.81610666 0.02576966 -1.95159667 -0.50359371 -1.92986464 Al 5.41808010 0.02932808 1.85025249 -0.62549879 -1.61833527 -1.18159900 Pd 3.64980075 1.80005279 1.79274676 2.91619658 -0.66464724 0.10437655 Pd 7.23827763 0.00108275 0.03814853 -0.13519056 0.13876457 0.21166396 Mn 9.07560984 1.77840304 0.00534809 -1.74841947 0.36980497 5.72225624 Mn 9.10030946 0.00082449 1.82171054 -1.40596440 3.46315448 -1.43986788 Al 7.22981548 1.82278380 1.84679908 2.81852533 -0.80911616 -1.25402555 Mn 0.00473263 3.64092069 0.01900979 1.87364159 -0.61795022 3.69450657 Al 1.80558724 5.41932880 0.02989190 0.66404347 -1.85828235 -0.94726839 Mn 1.78745845 3.61315356 1.78178432 -2.46086343 -0.23891209 -1.18130513 Pd 0.03390430 5.42110194 1.83859679 -1.43718350 0.90801868 -0.41235474 Mn 3.62531936 3.60637761 0.02350841 2.80130134 4.32715169 0.98617608 Mn 5.45794192 5.45841642 0.01688732 -6.37767825 -1.83895028 -0.48679722 Al 5.45328708 3.64518688 1.81493448 -1.28625981 0.99200657 -0.49573814 Al 3.59287282 5.46350331 1.82347932 0.67306398 -1.02455793 -1.86497974 Al 7.28371516 3.60036210 0.03537407 1.85045712 1.56660932 -0.96211587 Mn 9.10362994 5.42621004 0.00600429 0.10268990 -0.74013441 4.00560862 Mn 9.03153466 3.62932722 1.82122819 0.07673725 -2.32001114 -4.01098967 Pd 7.23258737 5.46769855 1.79745605 -0.85677093 -2.53751665 -0.12456224 Al 0.01343716 7.23256775 0.03507365 -0.93961388 1.25516326 0.14852257 Pd 1.83341281 9.08627746 0.06042081 0.08905950 -0.10085129 -0.39074332 Al 1.76998980 7.28005652 1.79886293 -0.37448620 1.61534742 0.98929040 Mn 0.00486868 9.07934199 1.79481640 -0.21071395 -3.33896081 0.95046643 Mn 3.65697779 7.28984171 0.01228922 1.48815250 -2.81710587 1.69557256 Pd 5.41666399 9.04308309 0.01725166 -1.70207179 1.20079159 -0.98605792 Al 5.43737300 7.24545572 1.84880600 1.09092027 0.10312372 -0.87855873 Al 3.68041191 9.09755459 1.79903001 -0.35339396 0.54589134 -0.26318660 Pd 7.24716846 7.21925308 0.01933716 0.96554354 0.56643224 -3.54691472 Al 9.07195920 9.08411773 0.01591496 -0.64625540 -1.43673850 1.22444009 Mn 9.05927133 7.23939527 1.79595504 0.31658418 -0.08213116 -1.32297276 Pd 7.26118898 9.08149077 1.80314677 0.98207880 2.02659645 -0.33747767 Al 0.00114813 0.02768049 3.62533616 1.17962629 1.01649051 -0.40506359 Mn 1.80675979 1.86204662 3.61413587 -4.33762724 -0.27687901 0.54893862 Mn 1.83090138 0.03485250 5.45470733 0.10035079 1.16904747 -0.81302626 Pd 0.00339938 1.78966251 5.44058939 -2.19231458 0.97757588 -0.73866047 Al 3.66127531 0.03468228 3.64396918 -1.50723327 -0.21231773 1.22969850 Pd 5.44095395 1.86646344 3.64080819 3.69221577 -1.16625840 -1.65432175 Mn 5.46197342 0.00838146 5.42925212 2.12787251 -0.84916323 0.70124235 Pd 3.60142212 1.82033773 5.45445880 1.19929220 -1.90209138 1.38625268 Al 7.30114961 0.03468602 3.66403705 -0.14592424 -1.16532867 1.03595398 Al 9.10559009 1.83064073 3.60494671 1.43166722 0.67383413 0.30834598 Pd 9.07661863 0.02375730 5.43370706 0.26827724 -0.07924148 -0.04364843 Mn 7.29440587 1.80173636 5.46193574 0.70719651 1.49335155 2.12316799 Al 0.03661343 3.62024248 3.59584123 0.20829903 -1.08032663 0.10035416 Al 1.82478631 5.42473477 3.59509977 -0.61966877 0.32057717 2.49881243 Mn 1.81310034 3.64055600 5.41210562 -1.01879270 2.92547262 2.44975977 Mn 0.00032223 5.47422446 5.44927328 3.74146264 0.66823764 -2.11400306 Pd 3.67962274 3.59613595 3.64556797 -0.78909517 3.74670300 -1.51689260 Pd 5.44337812 5.47982112 3.62517704 1.13975583 -2.45225310 -0.06464041 Al 5.39649966 3.60671047 5.46256632 -0.05340363 0.01933247 0.15857317 Mn 3.61103651 5.47883152 5.48271052 -1.77462778 -0.63316414 3.59829317 Al 7.27226500 3.62183325 3.62220389 1.11413386 0.36154130 0.65918245 Pd 9.05227976 5.42810623 3.59630477 2.18479964 -0.97794602 0.68549784 Mn 9.06749365 3.66265259 5.43760405 -3.01494118 -1.87816435 3.64959175 Al 7.25268757 5.43666426 5.46801025 1.72839930 0.70127383 -0.35757123 Mn 0.00321538 7.23153451 3.61978338 1.28756725 0.04967901 1.08005875 Pd 1.81491369 9.08525104 3.66225484 0.82045000 2.51062075 -1.80625254 Mn 1.79397081 7.27736226 5.44067753 -1.49788828 -5.13154952 -0.66672184 Pd 0.03010245 9.10305573 5.45237559 -1.73840006 0.90031329 -0.43369872 Pd 3.63390655 7.24310977 3.59745612 -1.84076483 0.38409783 -2.15745798 Pd 5.43890007 9.11171078 3.64868954 -1.36036044 2.47737533 -0.98583436 Mn 5.42357745 7.28062856 5.43605569 -0.02813685 -0.00611350 2.63156979 Al 3.59796052 9.08412843 5.42263608 0.52841466 -0.12104695 0.26472906 Mn 7.23960766 7.25155374 3.63446309 0.58785661 1.28021307 0.75907016 Pd 9.07117743 9.09248243 3.63635665 1.72172604 0.37951625 -1.06144920 Pd 9.05802019 7.24931512 5.42726385 1.88594497 -1.97224542 0.89604854 Pd 7.26478606 9.04956908 5.47855796 -1.35860489 2.41587774 0.71738060 Pd 0.02309870 0.01819935 7.28570172 -1.40292635 -1.33790755 -0.04226360 Mn 1.84374458 1.81796491 7.29837869 0.50755415 2.10102262 1.09984356 Pd 1.78469611 0.01369121 9.09829926 1.69772270 -0.27953180 1.23840086 Al 0.02650601 1.79676432 9.08697873 0.93918958 0.14288229 -0.04150200 Al 3.66223346 0.00597239 7.26728868 -1.75849779 -0.98094781 -1.58204953 Al 5.42170013 1.81038351 7.23585858 0.66390729 0.94796239 -1.70240443 Al 5.45106983 0.00717449 9.08422480 -0.08299159 -1.35989849 1.61682164 Al 3.61490826 1.83495537 9.10227672 -2.06971313 1.33966149 0.31729856 Al 7.26781490 0.03587800 7.27532751 1.71277969 -0.32400571 -1.28828758 Mn 9.09270128 1.82820785 7.32933550 -3.12031808 -0.54775323 -0.80428959 Mn 9.11174512 0.02582544 9.06713314 -1.49543493 3.17118349 -2.72547404 Al 7.24551030 1.86844176 9.07803001 2.67583561 0.02903065 0.37395304 Al 0.01719771 3.59654655 7.24961649 1.37195996 1.27038670 -0.81130288 Mn 1.81752493 5.41569866 7.26592362 1.64768641 -3.68485145 -3.11973596 Mn 1.77947052 3.61773116 9.09421152 2.25038293 -0.77195134 -3.76399791 Pd 0.02498500 5.42495096 9.09993257 -1.32728176 -1.23519467 1.27469660 Mn 3.64887167 3.63007794 7.23104631 -2.45329131 2.30412089 1.95629011 Al 5.45072829 5.43873084 7.21766326 -0.00878939 -0.04967642 0.31072005 Al 5.48013847 3.65205484 9.07142355 0.65381554 1.06441775 0.36575865 Al 3.62083186 5.47659443 9.09425647 -1.81401072 -0.92352255 0.37593671 Mn 7.26467645 3.64736866 7.25093198 1.97793822 0.67768356 -0.96449872 Mn 9.04247298 5.43371396 7.27136081 -3.50390086 -1.10637343 1.82218164 Pd 9.08134143 3.61200616 9.09876145 -0.18204296 -0.02274374 0.54171146 Mn 7.26416964 5.41613468 9.05190383 2.66195798 -0.15975081 -2.88650804 Pd 0.02602670 7.29596152 7.27873323 -3.45156647 -0.50852265 -0.02175961 Pd 1.84759996 9.06347188 7.25145233 0.50495473 3.37528022 -0.73385279 Pd 1.81358706 7.29589915 9.07308196 1.06386295 -0.93245902 3.24911243 Al 0.03070714 9.06819687 9.08453808 0.33396328 -0.23072580 -0.37438032 Al 3.61373103 7.23752255 7.23633174 -0.22991681 0.68505547 -0.82279961 Mn 5.47027062 9.07196634 7.24651415 -1.73070220 -1.30100656 -1.48614840 Pd 5.45328404 7.24349164 9.05632307 -0.76774229 -1.25144126 1.02237032 Pd 3.60244071 9.11216428 9.07092400 1.63818247 1.42081870 1.19040688 Al 7.25535362 7.25109094 7.28046568 0.80731062 0.82825662 1.01349818 Pd 9.05822933 9.05152188 7.24100774 2.51699906 0.83662214 1.43796529 Mn 9.04701313 7.29101803 9.05187885 -1.99935040 -3.96412310 -2.64764939 Pd 7.29964052 9.08225565 9.08421428 -0.23662440 0.92980301 0.71039776