108 Lattice="10.966430603009812 0.0 0.0 0.0 10.966430603009812 0.0 0.0 0.0 10.966430603009812" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-457.79137806575426 pbc="F F F" Mn -0.02416305 -0.03473213 -0.01077938 25 2.77306579 2.36177355 0.97351179 Mn 1.83195223 1.80378792 -0.00502459 25 1.19447485 -4.98798846 -0.84043320 Al 1.79976101 0.01289587 1.80492690 13 -0.09584880 -0.57759947 -1.38879770 Pd 0.01698782 1.83335929 1.85217575 46 -1.82682999 -1.45284116 -0.46311006 Mn 3.67898491 0.01753965 0.03000164 25 -1.49673284 3.18962438 1.39728823 Al 5.44980317 1.80269166 -0.02526874 13 1.43502988 0.20237793 -0.42494124 Al 5.48985197 0.01186526 1.87345306 13 0.43202270 -1.25388667 0.29187259 Al 3.61914361 1.81733477 1.81759659 13 0.29351290 0.29964397 0.24888250 Mn 7.30518987 0.06035125 0.05767763 25 -0.31266832 -0.13658780 -0.32481822 Al 9.11581067 1.82565874 -0.00871757 13 -1.39386170 0.00389482 0.40980015 Pd 9.13543038 -0.03366853 1.82738357 46 0.59350331 -0.76537450 -0.33720771 Pd 7.31086420 1.79893722 1.81810779 46 0.19238522 0.45771281 -0.42295240 Pd 0.01948973 3.67703385 0.00585522 46 -1.38204627 -1.28543300 -2.55199439 Pd 1.84412967 5.45448112 0.03257051 46 1.47662347 2.42080634 -3.82919764 Pd 1.83586883 3.62514814 1.79553849 46 1.86345606 -1.24595585 1.87404576 Pd 0.02437105 5.45995869 1.84422175 46 -2.32769425 1.69849462 2.07477391 Al 3.58269535 3.67051218 -0.02600806 13 -0.18947828 -0.16357039 -0.13185449 Pd 5.47506892 5.47616046 -0.01528626 46 -0.99168242 -0.79404783 -3.18069214 Mn 5.46867292 3.65853258 1.81553773 25 -0.73552411 0.81240678 -0.00379813 Pd 3.64904679 5.51069218 1.85911143 46 -1.33514299 1.95267232 0.00685458 Mn 7.31502660 3.62479966 -0.00222350 25 -1.96847055 -1.29118850 -0.01517110 Pd 9.10261157 5.50221953 0.03593635 46 2.11549319 -0.64599169 -2.12833225 Pd 9.16739177 3.69045649 1.80056627 46 2.36560313 -2.62396637 0.38817689 Pd 7.29277502 5.46900215 1.87419142 46 -0.63168717 -1.33386521 0.07169415 Pd 0.00888843 7.36562846 0.01142887 46 0.06093676 0.32363242 -1.42052805 Al 1.83670457 9.11460481 -0.02215274 13 -1.05168586 0.84811666 -0.57381100 Al 1.81848368 7.32832782 1.85625372 13 -2.14270444 -1.18509728 -0.28629929 Pd 0.01433602 9.12685498 1.85790656 46 0.53065424 1.16117348 0.61393986 Al 3.64235895 7.32900237 -0.01582175 13 1.91975726 -0.82690633 -0.42279237 Mn 5.45142845 9.11277589 -0.00208383 25 -0.21004809 -2.69074919 4.33944392 Mn 5.50222944 7.31505731 1.80525372 25 -2.08516835 6.72509477 0.94985682 Al 3.65606330 9.12648829 1.83126096 13 2.99214948 1.18948200 -0.17379405 Pd 7.36114599 7.33363123 -0.00425800 46 -0.69377832 2.30352652 -2.36536627 Mn 9.14781457 9.11027179 0.00809260 25 -1.73069600 -2.56591737 4.88514413 Mn 9.13470852 7.31163883 1.78256671 25 0.68024485 7.82023642 -0.34391014 Mn 7.33978124 9.10561068 1.82191098 25 1.00995441 -2.27100592 -0.53745849 Pd 0.03751099 -0.00227370 3.67416204 46 -0.51214757 -0.56054954 0.13601660 Al 1.85495496 1.81261371 3.62862901 13 -0.88667861 1.15785742 2.14188719 Pd 1.85570355 -0.00328084 5.48862283 46 -0.47443046 -1.81750642 0.47868657 Mn 0.01867971 1.86246219 5.54625064 25 0.83029469 2.14976840 0.02069014 Mn 3.64311503 0.00736397 3.66323077 25 -0.10247798 -1.53072413 -1.97960279 Pd 5.47786240 1.81890869 3.64294252 46 -0.06267787 -1.55641056 -1.23958881 Al 5.46687067 -0.01361027 5.49801290 13 -0.33970580 0.88903864 -0.50874781 Pd 3.65274777 1.87390024 5.50803391 46 -1.33145152 -0.86926028 0.76603636 Mn 7.34639248 -0.01850155 3.67772665 25 2.20980758 0.81247392 4.74513619 Al 9.15435457 1.84928145 3.66232888 13 -0.49494318 -1.62030788 0.94090762 Mn 9.11264095 -0.01932541 5.48831932 25 -4.77748067 1.91303862 -3.26068879 Mn 7.27916267 1.85595596 5.49062975 25 2.10053903 -6.38635822 -2.02825930 Mn 0.01129119 3.64021545 3.66482340 25 1.49349077 -1.42693586 5.57505208 Al 1.81348221 5.48788580 3.69988943 13 -0.84090771 -1.06484926 -0.21592640 Mn 1.79696973 3.64830914 5.49207923 25 -2.49448644 0.93154139 -2.01161556 Al -0.00972674 5.45039596 5.47407594 13 -0.30407709 1.12953330 -0.89465319 Mn 3.66476992 3.68001102 3.66465682 25 -0.31975946 1.61529446 0.08973591 Mn 5.45412070 5.49433904 3.67883880 25 -1.88753934 -2.10157392 -1.37997740 Pd 5.50245613 3.67054205 5.46283791 46 -0.24697859 2.81383958 0.90931470 Al 3.66335579 5.50278206 5.49598731 13 -0.17814683 -0.94113533 -1.53235278 Al 7.29685526 3.60083387 3.65855985 13 -0.74728934 0.57700909 -0.64137642 Pd 9.15603882 5.46784345 3.63180374 46 2.64858284 0.56545533 1.94204547 Pd 9.13973006 3.63985998 5.47972070 46 1.77595952 1.12901790 -1.60101751 Al 7.30439018 5.50095429 5.51686788 13 -0.36409338 0.28909028 -1.03133722 Mn 0.00715676 7.32870165 3.62828551 25 3.18214803 -0.37664614 2.09002300 Al 1.82891565 9.15442877 3.65762228 13 -1.34703835 -0.02617941 1.21298092 Mn 1.81226468 7.30089572 5.48982296 25 -2.49867191 -2.12920089 -1.22754930 Pd 0.02005151 9.16641698 5.44683495 46 -0.86932481 -0.10084495 -0.91196352 Al 3.67800792 7.32375140 3.60461201 13 1.85486549 0.12704987 1.01455211 Mn 5.52391488 9.16743943 3.63890023 25 -0.55632455 -0.48749092 -5.05615621 Pd 5.45085920 7.31937220 5.48816129 46 -1.24240732 -2.28282563 1.64803336 Pd 3.66368155 9.12533150 5.47357435 46 -0.07720829 2.31408140 -0.89965092 Pd 7.33488069 7.30672004 3.66010877 46 0.68597897 -0.01031030 0.79851742 Mn 9.12721095 9.14012964 3.65722722 25 -1.09197724 -2.08854498 -3.89548620 Al 9.13066480 7.30119990 5.49665282 13 0.20729387 1.35331522 -0.50274987 Pd 7.29486634 9.11202098 5.51201495 46 0.34641795 2.92963065 0.60070458 Mn 0.01751914 0.01199695 7.31640800 25 0.24668767 2.91195162 -0.56031946 Al 1.78140047 1.84163794 7.34284114 13 0.96867161 -0.59790750 -1.08034046 Al 1.79345993 0.01485611 9.12692400 13 1.32476690 -0.35072673 -0.86434269 Al 0.02145353 1.84905790 9.13697121 13 -0.46004111 0.09953050 0.47064723 Mn 3.62037143 -0.03100266 7.28911275 25 2.03631168 1.93998323 2.75686287 Mn 5.49359535 1.81560808 7.30778373 25 -1.24683092 -1.80699312 4.26097371 Pd 5.45521561 0.05645644 9.11933796 46 0.38169537 -0.88425465 0.25662526 Mn 3.69958076 1.83206378 9.10706567 25 0.26255110 2.42225784 -3.72670579 Al 7.31367700 0.00078334 7.33297597 13 0.83135103 1.51217113 0.07396443 Pd 9.14225628 1.83741104 7.28364732 46 2.24536028 -1.70382495 0.61766309 Pd 9.12103081 -0.00042980 9.12233699 46 -1.17669196 0.03552514 0.61897261 Mn 7.36065006 1.85129360 9.13024115 25 -0.40474214 2.58898255 -0.46373376 Al -0.00086805 3.67532110 7.36044710 13 -0.00190125 -0.30352314 -0.61636813 Al 1.84948564 5.52079211 7.28721215 13 -1.18968173 0.56776900 1.38728378 Mn 1.82585814 3.67594756 9.16529340 25 0.97193952 -2.68930856 -1.23695378 Pd 0.00810796 5.50932325 9.15267875 46 -0.25364953 -0.56948117 -0.01230462 Al 3.65675176 3.64815552 7.28573232 13 0.11190619 -1.53027098 1.76211343 Al 5.51661086 5.48568995 7.30268267 13 1.35112007 -0.30027508 1.66316390 Mn 5.47639638 3.62789590 9.11688803 25 0.65146371 -2.75169659 -1.13464670 Pd 3.65415288 5.45378864 9.13721080 46 0.56146481 0.99077452 0.24964868 Pd 7.26200685 3.62070953 7.27627462 46 0.69211018 2.85243373 1.05912997 Al 9.14388383 5.45028359 7.33909366 13 -0.48130438 -0.88263781 1.19027350 Mn 9.11937998 3.61108698 9.10985987 25 -3.36540309 0.61340347 0.89954249 Mn 7.29727883 5.48547149 9.16463010 25 0.03067926 -0.59334776 -1.98474776 Mn -0.00786945 7.32409999 7.32647442 25 3.01311089 -0.41975797 0.37974289 Pd 1.83893741 9.12349790 7.28805458 46 0.25659599 1.56051734 2.32427929 Mn 1.83180408 7.29689488 9.14010621 25 -1.10586764 1.12768107 -2.20731524 Al -0.00867484 9.15120845 9.11774538 13 1.15769996 -1.87940504 -1.03785917 Al 3.65631793 7.30339962 7.31010539 13 -1.76642703 0.33318149 -0.35125639 Al 5.49807778 9.10261412 7.31791408 13 1.65538694 0.96932311 -1.08354010 Al 5.51526923 7.33770251 9.11774653 13 1.82803486 -1.47491659 1.16451371 Al 3.67515220 9.10808016 9.11406646 13 -1.61523114 0.30722718 1.00995141 Mn 7.29858696 7.27956446 7.30564393 25 1.01289316 -2.47393108 3.32123060 Pd 9.14511034 9.14756493 7.28399162 46 1.40981009 -0.45198380 0.54109064 Al 9.17221601 7.28276655 9.16035097 13 -1.74378525 0.13752748 -0.58188859 Pd 7.31765964 9.16948407 9.14703529 46 -0.80432720 -0.29807555 0.28500400