256 Lattice="13.827068328857422 0.0 0.0 0.0 13.827068328857422 0.0 0.0 0.0 13.827068328857422" Properties=species:S:1:pos:R:3:forces:R:3 energy=-978.4616248260513 stress="-0.01013788250439975 -0.0004366240645675363 -0.00033402833444625774 -0.0004366240645675363 -0.010011374773283028 0.00012938397048727418 -0.00033402833444625774 0.00012938397048727418 -0.010103771286016736" free_energy=-978.4616248260513 pbc="F F F" Ni 0.02266890 0.01978584 0.01821610 0.48924564 0.45454294 0.49285881 Ni 1.70730063 1.72099197 0.00999164 0.39649857 0.11308945 -0.11399781 Ni 1.69740718 0.00783448 1.75898131 0.51762885 -0.19618057 -0.28738776 Ni 0.01797476 1.71944766 1.72123148 -0.26985919 0.25349917 0.12128601 Ni 3.43250090 0.00314389 0.02984655 -0.21165635 0.24597189 0.24262806 Ni 5.16213076 1.69489318 0.00166724 0.19148451 0.34563212 -0.26683190 Ni 5.16933791 0.00880697 1.70491480 0.11983390 -0.35275263 0.31672150 Ni 3.48989603 1.73193360 1.74226778 -0.36281768 -0.09683730 0.00146492 Ni 6.94245638 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0.00425342 -0.29811327 0.15751221 -0.18145788 Ni 5.15136317 8.65083221 0.02601486 0.37483164 -0.18357093 -0.48940794 Ni 5.20240883 6.90778658 1.75990247 -0.17704811 0.04498533 -0.40807440 Ni 3.46053953 8.65076241 1.71548221 -0.38000140 -0.14705479 0.32165343 Ni 6.94752328 6.89002791 0.03355284 -0.52500056 0.21714184 -0.55593971 Ni 8.61966906 8.68215694 0.00091699 0.12940608 -0.21924515 -0.46674757 Ni 8.61504721 6.87159006 1.69739801 0.28356810 0.41238915 0.54383582 Ni 6.93567483 8.64176728 1.73792720 -0.16747932 0.14355886 0.03237692 Ni 10.34206145 6.93257360 0.02115639 0.04435677 -0.09978798 -0.48010256 Ni 12.11357094 8.63622734 0.01681470 -0.41514539 0.15545019 0.22291294 Ni 12.07875843 6.93699408 1.69965612 0.33874056 -0.24560286 0.12920816 Ni 10.33898536 8.61560398 1.74584486 0.10630522 0.48766787 -0.05784204 Ni 0.03434992 10.37891233 0.00682852 0.13975784 -0.09620660 0.25101036 Ni 1.69698969 12.12601116 0.00311571 0.32831554 -0.46368602 0.46441250 Ni 1.70327507 10.36875345 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0.01899826 3.43538209 -0.19471442 0.15083723 0.09475939 Ni 1.75660607 1.72148936 3.46477713 -0.19131352 0.31672185 -0.21827818 Ni 1.69937821 0.01756472 5.17777202 0.32152497 -0.55809891 0.13799627 Ni 0.01122073 1.70704128 5.21136149 -0.57630351 0.32352018 -0.35369894 Ni 3.43634573 0.00170747 3.46957124 0.17983292 -0.47908820 -0.26030293 Ni 5.19914133 1.75714053 3.48020089 -0.26737115 -0.28721551 -0.29461211 Ni 5.21042145 0.00890609 5.15620906 -0.29174315 -0.58116842 0.16888420 Ni 3.45916598 1.72645767 5.15150352 -0.08884843 0.13392744 0.50289388 Ni 6.92811639 0.01545543 3.42654452 -0.10760367 -0.46989223 -0.05248765 Ni 8.65587047 1.70337539 3.43627022 0.15850267 0.46385964 0.20007316 Ni 8.64055099 0.02085821 5.18694437 0.27618596 -0.47360367 -0.08114260 Ni 6.88923059 1.70454570 5.20756198 0.37622783 0.44552877 -0.10915597 Ni 10.40300245 0.03410756 3.42233419 -0.15308083 -0.53624122 0.13807459 Ni 12.11369793 1.69851067 3.47616953 0.15432790 0.41863792 -0.30570084 Ni 12.06858259 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12.07250888 -0.38843319 -0.14006202 0.64396034 Ni 6.93810574 5.21943261 12.08773693 -0.10759948 -0.36077168 0.71680030 Ni 10.37911312 3.42501599 10.39089645 0.25372766 0.50944806 -0.33966004 Ni 12.11233151 5.21643609 10.39174896 0.13203338 -0.36125033 -0.35906550 Ni 12.08282153 3.46293141 12.12187328 -0.25039626 -0.10835822 -0.39853290 Ni 10.39338329 5.20690242 12.09186453 -0.08340878 -0.18447749 0.28217954 Ni 0.02689801 6.92945927 10.42191496 -0.58522935 -0.29029230 -0.28992534 Ni 1.71132225 8.64769106 10.37145258 0.34173231 0.11183653 0.23123832 Ni 1.70763713 6.86604210 12.10684135 0.34154689 0.24052744 0.25852048 Ni 0.00541609 8.63090733 12.07867180 0.28669003 0.25179506 -0.08222646 Ni 3.45862558 6.93645621 10.38051811 -0.18524893 -0.46214155 -0.06762820 Ni 5.21273591 8.67281123 10.35542361 -0.15470360 -0.18789600 0.23983298 Ni 5.15867857 6.89094884 12.12070764 0.23615966 0.31462515 0.21822425 Ni 3.45295022 8.63048583 12.06869051 -0.22725568 0.24475811 0.50672679 Ni 6.91586367 6.88522672 10.38554704 -0.24128781 0.52301871 -0.15083265 Ni 8.66294491 8.63076414 10.37545197 -0.49378143 0.29013394 -0.12253858 Ni 8.66596426 6.90249540 12.07530281 -0.03198505 0.20438916 0.66351170 Ni 6.88230878 8.62451656 12.10574560 0.33841278 0.15698190 0.24624062 Ni 10.39500976 6.92057358 10.40438891 -0.30211339 -0.26642880 -0.63910886 Ni 12.06419323 8.64741439 10.34476289 0.77167638 0.14628251 0.32619981 Ni 12.09505146 6.92396526 12.06631514 -0.07990427 0.16284721 0.01436523 Ni 10.35024688 8.65415789 12.09680804 0.27448624 0.16760649 0.40206551 Ni 0.02597484 10.39212427 10.38859129 -0.28725846 0.10691419 -0.14005432 Ni 1.73974153 12.10840895 10.37275908 -0.11992941 0.10190165 -0.15744637 Ni 1.70054355 10.40417348 12.07165599 0.19594692 -0.25702231 0.33498084 Ni 0.00243185 12.12718215 12.13065643 0.70970029 -0.68109632 -0.77142921 Ni 3.45568910 10.38741251 10.38142230 -0.27337462 -0.31604975 -0.18384018 Ni 5.16751521 12.06766196 10.38613899 0.18468343 0.58975780 0.02473691 Ni 5.17663512 10.36240867 12.11835192 0.01188859 -0.04249475 0.30445700 Ni 3.45754583 12.06713017 12.09579890 -0.14178825 -0.11290914 -0.13429497 Ni 6.90090076 10.39383130 10.40444360 0.27438729 -0.35806285 -0.28271121 Ni 8.67181119 12.07978584 10.39686032 0.00180091 0.51899579 -0.19302531 Ni 8.67647522 10.39532798 12.06534631 -0.13103321 -0.35075735 0.49985101 Ni 6.93350060 12.07779883 12.11100762 -0.12372460 -0.17418821 -0.22550206 Ni 10.38425838 10.34367740 10.33706726 0.16337090 0.59069540 0.32458829 Ni 12.12783539 12.11843194 10.40190817 -0.64027597 -0.64567900 -0.38863518 Ni 12.13038185 10.37333101 12.12242638 -0.59077505 -0.23373104 -0.61010682 Ni 10.39813431 12.08479705 12.09278186 -0.05155210 -0.39582448 -0.38128542