256 Lattice="13.957962799072272 0.0 0.0 0.0 13.957962799072272 0.0 0.0 0.0 13.957962799072272" Properties=species:S:1:pos:R:3:forces:R:3 energy=-1018.5025559775147 stress="-0.007749880249999821 0.0004318146854399075 -0.0001209723916690253 0.0004318146854399075 -0.0080740176796644 -0.00030693740425670517 -0.0001209723916690253 -0.00030693740425670517 -0.007912687958866729" free_energy=-1018.5025559775147 pbc="F F F" Ni 0.00843919 0.00131348 0.00146417 0.55959236 0.56872127 0.52681383 Ni 1.76441600 1.72201027 0.01438338 -0.34359011 0.29657460 -0.41221827 Ni 1.74574358 0.00551006 1.71586221 -0.01250133 -0.45247247 0.24196289 Ni 0.02838696 1.70924773 1.75979398 -0.40030913 0.16507833 -0.46315239 Ni 3.46136318 0.01744336 0.02495712 0.30139652 0.01100267 -0.01744668 Ni 5.26670417 1.72760460 0.02150985 -0.36443365 0.24559183 -0.36569115 Ni 5.22041875 0.01426399 1.75001504 -0.10873273 -0.38408314 -0.09987766 Ni 3.48391450 1.75939340 1.72613556 -0.17904306 -0.19022958 0.12014450 Ni 6.96723483 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0.04086700 0.02177834 3.48921728 -0.00423305 -0.21957818 0.02319184 Ni 1.72362894 1.72334518 3.49493963 0.66412109 0.27993174 -0.13239874 Ni 1.76978429 0.03312145 5.25476030 -0.27924343 -0.37555522 -0.17008910 Ni 0.01278216 1.73961271 5.20430500 -0.28242777 0.26458451 0.32082038 Ni 3.49731789 0.00816846 3.50174707 -0.16956214 -0.17845101 -0.17372977 Ni 5.20008696 1.77588049 3.45604239 0.28194296 -0.32134953 0.54505172 Ni 5.21092644 0.02075360 5.25116415 0.27548065 -0.27698985 -0.12788471 Ni 3.50646681 1.73984294 5.26298691 -0.39728031 0.39578528 -0.47989883 Ni 6.95340768 0.03216476 3.45809973 0.09066279 -0.38327551 0.38282919 Ni 8.69955098 1.76225777 3.50831777 0.08923804 -0.10983172 -0.44726088 Ni 8.73580687 0.02559734 5.23528903 -0.33616434 -0.37005265 0.17255769 Ni 6.97108864 1.71658245 5.26836178 -0.12374583 0.38049537 -0.33961112 Ni 10.43747240 0.02744850 3.51257171 0.37201278 -0.31906911 -0.27598402 Ni 12.21467560 1.75388268 3.45540263 0.31444923 -0.33211184 0.44466118 Ni 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8.75427987 3.46468798 12.20487567 -0.31853308 0.34058437 0.29018322 Ni 6.96038391 5.25445351 12.23608609 0.35270378 -0.31525179 0.17274517 Ni 10.44147496 3.45988168 10.43448076 0.16389951 0.51715411 0.52137182 Ni 12.21611642 5.21246342 10.47095090 0.00252710 0.24384353 0.10735161 Ni 12.21127483 3.51583738 12.19341937 -0.39082448 -0.19581153 -0.18027158 Ni 10.44381275 5.21666157 12.23646533 0.09427216 0.12805143 -0.08255342 Ni 0.02173039 6.95196977 10.43364553 -0.38458491 0.29200391 0.51028926 Ni 1.77888198 8.75643087 10.45282067 -0.29377121 -0.48587504 0.45583523 Ni 1.74697315 6.94737114 12.21385881 -0.10963892 0.24083743 0.17162829 Ni 0.01273792 8.69968921 12.21773085 0.44485694 0.06046076 -0.46721231 Ni 3.47755710 6.98907564 10.49988558 0.17487038 -0.22364718 -0.21625626 Ni 5.20732970 8.75684852 10.48386185 0.18683619 -0.36685006 -0.29823951 Ni 5.21515995 6.93702402 12.23535888 0.09365601 0.38464341 0.19255378 Ni 3.50880299 8.69886737 12.23483570 -0.24978393 0.24278309 0.21440513 Ni 6.96487443 6.98366789 10.49583517 0.09559259 0.28985189 -0.19692443 Ni 8.75291590 8.70100510 10.44353277 -0.38201415 0.26570185 0.39103042 Ni 8.70744407 7.01728914 12.23579930 0.02435097 -0.27597475 0.13562094 Ni 6.96408316 8.75784880 12.21764055 0.15249254 -0.23555559 0.03505465 Ni 10.45469148 6.97032288 10.48927133 0.25108524 -0.14988432 -0.26332592 Ni 12.22164642 8.75053206 10.50316887 0.18980446 -0.33028282 -0.20519707 Ni 12.21081486 6.95279012 12.19636553 -0.25255456 0.00959809 -0.19261956 Ni 10.47437800 8.71084136 12.20032215 -0.04866792 0.14009245 0.38342179 Ni 0.00045019 10.46651558 10.48111222 -0.14062715 0.15843682 0.20213397 Ni 1.74195902 12.22376019 10.47739248 -0.21933523 0.32087402 0.19957009 Ni 1.77362050 10.48125455 12.20644699 -0.29845912 -0.11894717 0.30347696 Ni 0.02450966 12.17874326 12.23513550 0.55204330 -0.52415286 -0.56833906 Ni 3.45561006 10.50040452 10.45270869 0.68381875 -0.30209183 0.33322921 Ni 5.21274482 12.23016856 10.44314863 0.03071176 0.16502698 0.43391739 Ni 5.24682349 10.43932073 12.19284476 -0.26035332 0.70049018 0.26626629 Ni 3.48221864 12.21814870 12.22429795 0.13837490 -0.28153905 -0.31664232 Ni 6.96919773 10.49404053 10.43555682 0.07418521 -0.21665667 0.57213248 Ni 8.70227857 12.20576306 10.47628742 0.35966402 0.39781350 -0.05434463 Ni 8.70841970 10.49547492 12.20275372 0.21713290 -0.16419200 0.16861100 Ni 6.98883595 12.22650182 12.18949194 -0.28088820 -0.26426394 -0.20547349 Ni 10.45925032 10.46448950 10.47544910 0.15947139 0.39114405 -0.00029120 Ni 12.21523833 12.18798948 10.41729931 -0.37889815 -0.34888115 0.20890717 Ni 12.20122775 10.43964773 12.23213871 -0.31575767 0.29027624 -0.36445552 Ni 10.52482588 12.22953216 12.19366781 -0.15965063 -0.46319128 -0.44468784