108 Lattice="10.896360880042835 0.0 0.0 0.0 10.896360880042835 0.0 0.0 0.0 10.896360880042835" Properties=species:S:1:pos:R:3:forces:R:3 energy=-380.2917800987614 stress="-0.0010448936789726525 0.006484463790333229 -0.00027460950444940595 0.006484463790333229 -0.007092361995202667 -0.0023121978679870323 -0.00027460950444940595 -0.0023121978679870323 -0.01168451248514601" free_energy=-380.2917800987614 pbc="F F F" Al 0.01072344 0.03103160 0.00928694 0.65062689 0.41270887 0.44061079 Ni 1.81881950 1.81363178 0.02991120 0.19881083 0.11917532 0.26192989 Ni 1.85872737 0.00603130 1.85423501 -0.17951252 0.17830489 -0.20453326 Ni 0.01487953 1.78351917 1.76564596 0.14250886 0.09043709 0.49186158 Al 3.63573987 0.01865400 0.03363456 -0.73711497 0.33455219 -0.45600075 Ni 5.44649730 1.82333226 0.02606620 0.14526587 0.15327705 0.10293315 Al 5.46934864 0.03345233 1.82620310 0.63773148 -0.41254411 0.40107526 Ni 3.67588148 1.79601792 1.78925312 -0.37400732 0.45968280 0.41387643 Ni 7.21616940 0.01490391 0.03419955 -0.00237401 0.51445685 0.20761492 Al 9.09361218 1.84385182 0.02341011 0.14588032 0.39185875 -0.12848321 Al 9.06014683 0.03061686 1.80727397 -0.52629875 -1.06522356 0.25904830 Ni 7.26190441 1.85199907 1.85096638 0.14642606 -0.24035468 -0.26658129 Ni 0.01470006 3.58550347 0.02484402 0.43571194 0.05398660 0.35888419 Al 1.82142627 5.44212648 0.03390485 0.41537601 -0.53337243 -0.42065386 Ni 1.78254385 3.63641385 1.83968681 0.54676665 -0.14932700 -0.09454286 Al 0.02212881 5.44243084 1.81031658 -0.67442486 -0.54820736 0.46714035 Al 3.62724839 3.64206350 0.01336871 -0.87266304 -1.55261298 -0.22048701 Al 5.41461638 5.41255234 0.01849606 0.89448198 1.11258442 -1.00334126 Al 5.50038505 3.60911290 1.79514324 -0.39300829 -0.80370263 1.18190057 Ni 3.69187899 5.42874370 1.80910569 -0.45688188 0.15993260 0.03716440 Al 7.25190937 3.64679719 0.00729946 0.68311006 -0.23212702 -0.56852285 Ni 9.04960856 5.44463383 0.02127607 -0.49109956 0.05125141 0.65888868 Ni 9.08951492 3.66268832 1.88527990 -0.24124168 -0.27631825 -0.45020786 Ni 7.22085588 5.42049331 1.80041822 0.28990520 0.40351921 0.14011269 Al 0.03851719 7.28214356 0.03008101 -0.22232262 1.00942843 -0.27426023 Ni 1.84565421 9.07296782 0.01975853 -0.02358825 -0.40953378 0.38320121 Ni 1.81132495 7.23314991 1.83158299 0.33280380 0.23026885 -0.04103254 Ni 0.00813135 9.09873870 1.78033839 0.59650878 -0.49826411 0.30964154 Al 3.64763397 7.28912562 0.02374895 -0.82371349 0.73008092 -0.35381345 Ni 5.48622916 9.07109625 0.03355174 -0.11434174 -0.32188588 0.35925489 Al 5.44511064 7.24588971 1.83450559 0.79603157 -0.16628193 -0.40986191 Ni 3.61901176 9.06411197 1.78131325 0.11613408 -0.22580451 0.28895259 Ni 7.24595969 7.29883775 0.05364458 0.10937844 -0.35999254 0.08881739 Ni 9.06728983 9.10230429 0.03430102 -0.53977235 -0.67400192 0.55970080 Ni 9.07720673 7.26912566 1.83697657 -0.42656904 -0.12833984 -0.11874089 Al 7.24639498 9.04970691 1.83931160 1.30705995 0.50159344 -0.32654295 Ni 0.03337146 0.03576203 3.66484823 0.16381799 0.26580651 -0.45566380 Al 1.79536281 1.80645633 3.60076822 1.27640048 -0.76020195 -1.79049378 Ni 1.79107709 0.02724057 5.43406874 0.27983354 0.08289848 0.24529313 Al 0.03411535 1.80167037 5.43429294 -1.74961825 -1.35810430 0.19314562 Ni 3.59454024 0.06715616 3.64925788 0.31759687 -0.08079061 -0.16826617 Al 5.45480062 1.82827399 3.63444505 0.60220699 0.45922212 -0.51555253 Al 5.48428347 0.02236393 5.43310836 0.48276176 -1.51577148 -1.19306504 Al 3.61642720 1.78359689 5.43327506 -0.58649143 0.67437157 -0.29607099 Ni 7.26237322 0.02657399 3.64545772 0.06628653 0.09511758 -0.08347237 Al 9.08776327 1.78872545 3.64200431 -0.33631811 0.54115678 0.18548673 Ni 9.06025670 0.00259177 5.47186237 -0.46559956 0.42758846 -0.00891985 Ni 7.27462616 1.79377585 5.47688964 0.00174988 0.38104991 -0.14752508 Al 0.02369081 3.57948450 3.60663075 -1.12030175 0.35370738 -1.31351659 Ni 1.81336743 5.47592361 3.60495746 0.15549728 -0.20589182 0.25838474 Al 1.84655061 3.63202081 5.42816215 1.99823439 1.03112003 -0.36320479 Al 0.02075375 5.42083740 5.44419496 -0.97739959 1.42929656 -0.15473912 Ni 3.63257170 3.66626197 3.62478194 0.00857341 -0.44110777 -0.07616818 Al 5.44426618 5.41373098 3.60387622 0.29277587 -0.46025134 -0.21939606 Al 5.49636867 3.63749904 5.47273334 -0.39091800 0.20112882 0.37542311 Ni 3.64545009 5.46270218 5.46323249 -0.14203786 -0.18699091 -0.09818650 Ni 7.30171058 3.61473027 3.59832622 -0.32048423 0.08009372 0.48366169 Al 9.09679573 5.42101945 3.59661734 0.06424329 0.22236421 -1.60466184 Al 9.05851074 3.65739976 5.47416396 0.30697409 -1.65765534 0.39422350 Al 7.25020638 5.41410705 5.44665994 -0.53493102 0.63616453 0.34577683 Al 0.05829379 7.28882168 3.63721264 0.18209557 0.96674942 -0.23199860 Ni 1.84702061 9.07688367 3.63142320 0.02651256 -0.32289687 -0.03241460 Ni 1.78566376 7.27110615 5.45573992 0.38892159 -0.12648674 -0.19048503 Ni 0.03095195 9.09966019 5.45728599 0.37976004 -0.48906402 0.09272730 Al 3.65927931 7.23376376 3.65404676 -3.00216419 -0.06326783 -0.40404782 Al 5.41513012 9.05918658 3.61913775 0.15272363 1.50494137 0.59609236 Al 5.43543004 7.25053685 5.46421309 0.38885600 -0.37586816 0.84566042 Ni 3.65346368 9.07657050 5.41958666 -0.03040596 -0.27810906 0.27061855 Ni 7.29298049 7.23161269 3.65825289 -0.38151226 -0.00607072 -0.29005604 Ni 9.10536068 9.06012015 3.60169980 -0.55544083 -0.43514001 0.15486241 Al 9.09198362 7.25262990 5.41914210 0.14020000 0.92803427 -0.52600133 Ni 7.22327443 9.09172198 5.39435792 0.27714272 -0.37894831 0.16228527 Ni 0.02638395 0.02364003 7.25593798 0.24785666 0.30873431 0.02069016 Al 1.77662405 1.79262986 7.28502809 0.60103140 -0.64211304 0.75450396 Ni 1.79213157 0.02078846 9.05075606 0.21530236 0.25317578 -0.18367465 Ni 0.01649106 1.79020884 9.11518742 0.29127404 0.28198904 -0.51601162 Al 3.63544159 0.01463132 7.26452514 -1.27810329 -1.67977143 0.26687789 Al 5.47961752 1.81984878 7.24381080 0.35968158 1.62488537 0.60262043 Al 5.41288607 0.04511824 9.07575931 0.28757104 -0.19997243 1.66787260 Ni 3.60229102 1.78260914 9.06623640 0.06579273 0.38183348 -0.21960401 Al 7.24092144 0.00368180 7.27587498 1.94887297 -0.53618130 0.15474131 Ni 9.07504587 1.81949192 7.27298311 -0.32305326 -0.07436343 -0.03777962 Ni 9.09085509 0.00493357 9.11515384 -0.70393684 0.81981826 -0.60050384 Ni 7.27623220 1.84551936 9.10967793 -0.08206061 -0.11145542 -0.35780538 Al 0.02240679 3.62974647 7.23884694 -2.13023762 -0.82194697 0.59666852 Al 1.83106944 5.47514085 7.25745673 1.45705781 1.52729434 -0.60205321 Al 1.84255259 3.64198942 9.09860210 0.71903411 -1.50178646 1.31912872 Al 0.01399764 5.42701885 9.05980975 -0.87654876 1.46634950 0.89970147 Ni 3.64017788 3.63080678 7.27859719 -0.08265454 -0.15962430 -0.11731579 Ni 5.48111146 5.46914854 7.23088800 -0.22355246 -0.04776294 0.25658474 Al 5.45957058 3.66692679 9.11234130 -0.04708045 -1.34107073 -0.11349420 Al 3.65914345 5.41928486 9.11330623 0.39952795 1.82598142 -0.00469430 Ni 7.26587362 3.66820084 7.26786538 -0.02980075 -0.37225236 0.15352996 Al 9.04505077 5.45435636 7.24984382 1.02146915 0.76462581 0.65357600 Al 9.06497345 3.61643361 9.07040343 0.23035569 -1.21668650 0.15755913 Al 7.23208172 5.43288335 9.10195246 -0.50226186 1.57565084 0.27049298 Ni 0.05441504 7.28436206 7.28285846 0.00442559 -0.05716876 -0.25747248 Al 1.87702666 9.09109170 7.22985576 -0.02610853 -0.22587729 -1.23674223 Ni 1.82463059 7.29891439 9.07733999 0.24058994 -0.30265230 -0.18102212 Al 0.04008593 9.08071786 9.10506114 -0.07535446 -0.42265440 0.07292385 Ni 3.60327773 7.25014843 7.22231690 0.22564306 0.08809845 0.26343699 Al 5.49485102 9.03243173 7.26590704 -0.08552900 0.36370296 -1.00105703 Ni 5.45919681 7.25270841 9.07023318 0.02201238 -0.15083503 -0.32271631 Al 3.68131791 9.06607248 9.04758941 -0.11499473 -0.43391473 1.04352574 Ni 7.29306428 7.25028647 7.26200019 -0.10466371 0.14346839 -0.14524319 Al 9.06911692 9.08283077 7.25423072 0.07370127 0.12870188 -0.34863057 Ni 9.07132901 7.24898303 9.06773668 -0.35525731 -0.13983446 -0.35954423 Al 7.26390448 9.11600098 9.09862985 -0.22112742 -0.56378519 0.93619135