256 Lattice="13.978789568961243 0.0 0.0 0.0 13.978789568961243 0.0 0.0 0.0 13.978789568961243" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1028.6826299364786 stress="-0.00795734845921411 0.0001876767681048929 -0.0007935073149415102 0.0001876767681048929 -0.007999242069825588 0.00034267701059457583 -0.0007935073149415102 0.00034267701059457583 -0.008201183699813893" free_energy=-1028.6826299364786 pbc="F F F" Ni 0.01295207 0.00748652 0.02089569 0.24147565 0.14132874 0.28870524 Ni 1.71663325 1.71807113 0.02900409 0.60320363 0.49405501 -0.53374482 Ni 1.78259618 0.00354995 1.75677041 -0.20308147 -0.53872688 0.35024806 Ni 0.03306692 1.74836114 1.71495360 -0.53014826 0.05934528 0.73393212 Ni 3.49703287 0.04172723 0.04005829 -0.09171286 -0.32092066 -0.31394871 Ni 5.21066550 1.73441943 0.01808194 0.30325435 0.41791776 -0.27142826 Ni 5.20808350 0.00695354 1.77206115 0.39215320 -0.28794474 0.25114674 Ni 3.45986789 1.72214256 1.75506800 0.39665349 0.71559587 0.40811580 Ni 6.96185671 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0.00555893 0.00519169 3.51250159 0.00960740 0.08031545 -0.16549270 Ni 1.71863914 1.71634289 3.50170647 0.41513980 0.45571439 0.19156434 Ni 1.73542333 0.00599444 5.26060388 0.34888052 -0.32458028 -0.14882544 Ni 0.00032288 1.75825616 5.27226214 -0.31967977 0.12659374 -0.17476694 Ni 3.51213164 0.01460243 3.52895416 -0.30575701 -0.30902565 -0.15055210 Ni 5.26629295 1.76745603 3.49668723 -0.18023383 0.05072717 -0.21617142 Ni 5.21299679 0.01568795 5.21729205 0.42389430 -0.30571676 0.35073661 Ni 3.52375813 1.77105702 5.25345606 -0.53954579 0.05417366 -0.34261128 Ni 7.02173477 0.01999536 3.52461706 -0.28774568 -0.36069948 -0.26644577 Ni 8.72150805 1.73980547 3.46373096 0.22179007 0.13150894 0.48146278 Ni 8.77518313 0.01058267 5.22681760 -0.24127171 -0.26235955 0.10049862 Ni 7.00140593 1.77812925 5.27547623 0.02136420 -0.24897130 -0.29277918 Ni 10.49649156 0.02704309 3.46574555 -0.05229634 -0.53031396 0.19172144 Ni 12.23233671 1.75895180 3.52790892 0.31683411 0.13342914 -0.51638335 Ni 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8.73860743 3.50413695 12.23415509 -0.18355190 -0.00263323 0.33488666 Ni 6.96713678 5.23010846 12.21689101 0.12376066 -0.04662628 0.37634624 Ni 10.45087662 3.50466065 10.50926108 0.10094215 -0.14178641 -0.33864908 Ni 12.25205834 5.22243148 10.49196916 0.11806709 0.12785568 -0.27534304 Ni 12.24957334 3.49912322 12.23538974 -0.13800312 -0.11118007 -0.06213661 Ni 10.49169312 5.21045527 12.23697482 -0.33910567 0.32784314 0.18360833 Ni 0.00777488 6.96766839 10.49961923 -0.36491445 0.17844916 -0.24873368 Ni 1.76802219 8.74864154 10.45273561 -0.03247769 -0.21242749 0.25019187 Ni 1.73234201 6.98958089 12.20975641 0.40109043 0.10793804 0.32053268 Ni 0.00574914 8.76897740 12.21149776 0.08610497 -0.07692234 -0.14496555 Ni 3.51106188 7.00179344 10.49177072 -0.00323473 -0.25631124 -0.12272600 Ni 5.27372774 8.75273217 10.47075151 -0.15240087 -0.44244007 -0.03945741 Ni 5.26754905 6.97609370 12.21898842 -0.19507740 0.09778644 0.19656065 Ni 3.51440912 8.76651671 12.23989334 -0.25920668 -0.33857495 0.16201428 Ni 7.01365412 6.97704881 10.46228640 -0.32885828 0.24851805 0.04381428 Ni 8.71081053 8.75263979 10.48612528 0.38073576 -0.43278746 -0.20179642 Ni 8.71270653 6.99218246 12.21883544 0.28284700 -0.22501548 0.35529974 Ni 7.00069563 8.72273872 12.26020505 -0.14074827 0.17858852 0.16547233 Ni 10.49734292 6.99706628 10.48593644 -0.27473261 -0.21163412 -0.04983066 Ni 12.21389228 8.75572322 10.46890762 0.45058027 -0.30747874 0.27228905 Ni 12.22314685 6.94951965 12.25876772 -0.15093498 0.23568978 -0.27077374 Ni 10.45869993 8.72375271 12.20632171 0.08606097 0.08092296 0.43098449 Ni 0.00785062 10.45624047 10.42140409 -0.28804278 0.29041733 0.29212333 Ni 1.79600314 12.22564562 10.48681183 -0.21490545 0.16850657 -0.27649793 Ni 1.73475771 10.48682765 12.20905773 0.33417555 -0.18877363 0.14694950 Ni 0.00969198 12.22013931 12.21992484 0.39231860 -0.44947407 -0.53489209 Ni 3.52804953 10.46597937 10.44878627 -0.41170075 0.20233997 0.18234965 Ni 5.26193612 12.25533109 10.46098581 -0.08008490 0.17008278 0.21886959 Ni 5.21396606 10.45860724 12.19826764 0.42603580 0.25773537 0.36824429 Ni 3.47737119 12.23374317 12.25318139 0.16688634 -0.25907020 -0.26498137 Ni 7.01696014 10.45124248 10.47091538 -0.28857481 0.36996755 0.23705309 Ni 8.72676526 12.23748481 10.50814914 0.22236839 0.17328818 -0.44366750 Ni 8.74209110 10.48685907 12.22004707 0.13504887 -0.25143931 0.33883938 Ni 7.00828715 12.20137961 12.24117747 -0.24329874 -0.10832640 -0.09375143 Ni 10.49351818 10.45369814 10.45267266 -0.28740778 0.48793057 0.30405954 Ni 12.20945391 12.25549008 10.48911523 -0.24882927 -0.20658696 -0.27806665 Ni 12.20418667 10.51292818 12.21402111 -0.18379334 -0.35575026 -0.08744393 Ni 10.45235938 12.25593713 12.26457189 -0.15589801 -0.31168056 -0.37376892