500 Lattice="17.465848675384684 0.0 0.0 0.0 17.465848675384684 0.0 0.0 0.0 17.465848675384684" Properties=species:S:1:pos:R:3:forces:R:3 energy=-2040.3720470447665 stress="-20.258646734210263 0.12820191096423983 -1.785758112637751 0.12820191096423983 -20.910149604121855 -2.0486426460306717 -1.785758112637751 -2.0486426460306717 -20.571547698547974" pbc="F F F" Ni 0.01324963 -0.02812792 0.02943401 0.68302622 0.75615220 0.76616490 Ni 1.73656112 1.71723893 -0.02249316 -0.37055401 0.07063309 0.14634566 Ni 1.75705024 -0.01327514 1.76675840 -0.39208226 -0.00940760 -0.07250446 Ni -0.02709140 1.77107102 1.76455119 0.19034982 -0.30609586 -0.28754437 Ni 3.52458848 0.02111234 0.05422074 -0.25871756 -0.04280970 -0.19137692 Ni 5.27041643 1.72333558 -0.00672800 -0.12604647 0.11777745 -0.16497474 Ni 5.20565200 -0.00851081 1.75954672 0.38706064 -0.21638049 -0.03225595 Ni 3.47574821 1.72013676 1.71253089 0.14114160 0.37950312 0.43819079 Ni 7.01477238 0.02430350 0.03428815 -0.21726769 -0.03113472 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Ni 6.96745700 1.74175827 15.72156543 0.13879563 0.09806199 0.09514957 Ni 10.50083010 0.03231088 13.99790377 -0.22492142 -0.47942053 -0.23618269 Ni 12.19406033 1.76880661 13.96850255 0.14323318 -0.04141066 0.41772984 Ni 12.21960530 0.00223397 15.70916820 0.11114123 0.38690593 -0.14771809 Ni 10.46152733 1.72283269 15.70354463 0.17074717 0.29722506 0.30672574 Ni 13.94227070 0.03302235 14.00469548 0.52844548 -0.22448416 0.22152362 Ni 15.75246068 1.73758948 14.00218810 -0.11354369 -0.11813140 -0.12555974 Ni 15.72218446 0.01417169 15.72633371 -0.67549962 0.64912693 -0.63462449 Ni 14.00058730 1.76486050 15.75239136 -0.06861232 -0.23322278 -0.06317071 Ni 0.01766304 3.46275478 13.95714895 -0.43995237 0.25529765 0.35119874 Ni 1.79834594 5.25322214 13.94836207 -0.33154411 -0.27902683 0.37977490 Ni 1.71817459 3.46873753 15.70980916 0.07028175 0.20269821 0.19212657 Ni 0.01093347 5.23509103 15.69443546 0.33126987 -0.12253082 -0.34530109 Ni 3.51146316 3.47582078 13.99432269 -0.18771374 0.46427574 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0.21687859 -0.48477381 Ni 13.98285345 5.25894659 15.74227166 0.29461929 -0.19170732 0.09974373 Ni 0.03155153 6.95588686 13.97085319 -0.17779366 0.30189925 0.10183062 Ni 1.78059660 8.73278187 13.97464133 -0.44478567 -0.10536205 0.30567078 Ni 1.72137489 6.98136094 15.75007946 0.01984536 0.23917823 -0.02478088 Ni -0.02849036 8.79105907 15.70863982 0.47160077 -0.24352678 -0.51994551 Ni 3.51445870 6.99494275 14.02042733 -0.10601128 -0.00043597 -0.43292649 Ni 5.23867765 8.71799795 13.96633792 0.01834846 0.39433211 0.09845741 Ni 5.27452636 7.02578087 15.72362320 -0.09878172 -0.24913003 0.41657109 Ni 3.51538248 8.76066455 15.73001865 -0.27114307 0.01310711 0.10337337 Ni 6.95825027 7.00667408 13.97825700 0.42690035 -0.26729838 -0.20364803 Ni 8.72024274 8.76180882 13.97465798 0.31207408 -0.31840400 -0.43198422 Ni 8.74278864 6.99246067 15.68794309 -0.11829700 0.29946153 0.40900177 Ni 7.00393666 8.74333018 15.72487507 -0.22593005 -0.02404922 0.26035162 Ni 10.48501559 6.97103475 13.99161411 0.18453297 0.38793550 -0.48958246 Ni 12.22089272 8.76049130 13.97190606 0.24903485 -0.39803339 0.07435961 Ni 12.20112194 6.95188786 15.74345534 0.31733584 0.38117149 0.10238700 Ni 10.49591307 8.73056049 15.69598306 -0.09266224 0.10007810 0.24905664 Ni 14.00036473 7.01367952 14.00457327 -0.42638838 -0.14583814 0.02221897 Ni 15.73015986 8.72956449 13.96462164 0.09835602 0.12394999 0.30966863 Ni 15.71954083 6.95803482 15.74678687 -0.31136386 0.21869199 -0.43014426 Ni 13.95964615 8.75389720 15.74269424 0.13119207 -0.01007547 -0.10174791 Ni 0.03266060 10.50477437 13.94297957 -0.46111308 -0.21386712 0.14523404 Ni 1.74839342 12.22058629 14.00585754 0.12629476 0.35291967 -0.37390393 Ni 1.70496691 10.50429624 15.69023584 0.37785741 -0.28183191 0.43916118 Ni 0.01834840 12.22445627 15.74123759 0.12480931 0.13378398 -0.35351724 Ni 3.46836039 10.52187191 13.94459387 0.25413563 -0.30840565 0.41030836 Ni 5.21095240 12.25163501 13.95239321 0.42509097 -0.32525223 0.18426040 Ni 5.22612798 10.50140727 15.70469241 0.08362342 -0.07238470 0.03904017 Ni 3.49877743 12.24951300 15.74305431 -0.14946464 -0.14902366 0.18631854 Ni 7.01478659 10.48256920 14.00131433 -0.45564058 0.23014353 -0.52944072 Ni 8.76767652 12.23952762 13.95442820 -0.71380580 -0.24716276 0.41937741 Ni 8.71414126 10.44839819 15.71837909 0.44187459 0.38899202 0.23941136 Ni 6.98160887 12.21460051 15.75335338 0.19551118 0.16948879 -0.18016212 Ni 10.51188930 10.50105190 13.94925224 -0.41599519 -0.36560095 0.04378731 Ni 12.20203085 12.25050102 13.98532574 0.44390886 -0.16731099 -0.50368643 Ni 12.20244822 10.51153514 15.70994576 0.29419040 -0.28719386 0.25564389 Ni 10.49222582 12.20451850 15.70995187 -0.33813094 0.12411481 0.38191835 Ni 13.97164543 10.52617040 13.94657960 0.15916004 -0.41385678 0.48593418 Ni 15.69300120 12.27423021 13.96940524 0.17724146 -0.11142966 0.28480135 Ni 15.74852155 10.44211543 15.73301582 -0.60803853 0.23254541 -0.60365720 Ni 13.94339627 12.22386869 15.73251249 0.47294843 0.02027725 0.08352821 Ni 0.02040262 13.95775955 13.95419795 -0.21376684 0.42611338 0.52706892 Ni 1.75041145 15.72345584 13.98463353 -0.22776640 0.05941873 -0.12676566 Ni 1.73160311 13.99219773 15.71060030 -0.18919442 0.10512475 0.27911258 Ni 0.01646034 15.74336973 15.74704852 0.73169167 -0.78395252 -0.83125464 Ni 3.48988401 13.96604315 14.00454643 -0.04937806 0.21662552 -0.42921077 Ni 5.24416976 15.72014585 13.97622916 -0.03279822 0.10352077 -0.00757965 Ni 5.26430258 13.94892563 15.69943801 -0.13345501 0.34547468 0.35071780 Ni 3.47643991 15.71649036 15.69743131 0.14377196 -0.29794678 -0.16379266 Ni 6.95611613 13.98576537 13.94991401 0.58311653 -0.17413688 0.42172236 Ni 8.74007201 15.74758359 13.96821833 0.00133386 -0.17990868 0.12150648 Ni 8.76344107 13.97130427 15.73983316 -0.29967678 0.07795480 -0.11461535 Ni 6.98861390 15.69925579 15.74062185 0.08651064 -0.37651984 -0.45630096 Ni 10.45564524 13.94067798 13.96366836 0.22490664 0.61834862 0.12369654 Ni 12.20058840 15.70522227 13.95121743 0.03638381 0.17716255 0.14168315 Ni 12.21560076 13.96262796 15.70135685 -0.21190649 0.25173252 0.39043951 Ni 10.47254711 15.72078012 15.71916250 0.06551124 -0.37514363 -0.40636303 Ni 13.94100065 14.00602254 14.00224471 0.53558462 -0.16992837 -0.36514914 Ni 15.74518651 15.68792817 13.97309882 -0.60026409 -0.49472195 0.16622297 Ni 15.73496239 13.96932360 15.75418518 -0.67809125 0.07329460 -0.59163411 Ni 13.93963988 15.69499116 15.72564905 0.22199349 -0.33620921 -0.43088490