864 Lattice="21.517507745607276 0.0 0.0 0.0 21.517507745607276 0.0 0.0 0.0 21.517507745607276" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-2859.613507946955 pbc="F F F" Ni -0.01418204 0.03035804 0.01590266 28 -0.45701222 -0.52044276 -0.52547654 Ni 1.80851552 1.78332827 0.01964319 28 0.34602135 0.85448783 -1.25775652 Ni 1.82093316 0.02445989 1.76674677 28 0.33659923 -1.16008588 1.13285045 Ni 0.02110995 1.77583301 1.80811000 28 -1.15258552 0.86441175 0.76863241 Ni 3.56430928 0.01908036 0.01173292 28 0.37093561 -0.95370253 -0.76333535 Ni 5.35064328 1.76190347 0.01652789 28 0.37718469 1.00751072 -1.02095883 Ni 5.41198585 -0.01994866 1.80666296 28 -0.24129255 -0.96568328 0.57888262 Ni 3.62104289 1.80802391 1.79651786 28 -0.24048823 0.63319707 0.90109957 Ni 7.14883021 -0.02774379 -0.00587539 28 0.35499279 -0.50391807 -0.55317708 Ni 8.96635345 1.80032848 0.02453578 28 -0.24341500 0.53109103 -0.85788399 Ni 8.99185735 0.03512028 1.82567931 28 -0.44907617 -1.03495457 0.35507679 Ni 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5.34954972 10.75006964 1.79093537 28 0.66369296 -0.18711222 0.63326251 Ni 3.59734894 12.51769414 1.78733407 28 -0.25279162 0.81774674 0.98731282 Ni 7.21577433 10.74537823 -0.01563645 28 -0.37233792 0.07250967 -0.54190426 Ni 9.00036652 12.53292584 -0.02361798 28 -0.26163114 0.05971334 -0.53906531 Ni 8.97215787 10.76775428 1.81190325 28 0.21540198 0.00463731 0.42260604 Ni 7.15313912 12.56302008 1.77411451 28 0.49678629 -0.47886919 0.75351433 Ni 10.76930233 10.75040329 -0.01200420 28 -0.08460908 -0.02793147 -0.40304996 Ni 12.57086085 12.55904642 -0.03080182 28 -0.23996242 -0.20554132 -0.51843276 Ni 12.57404528 10.72863299 1.76233454 28 -0.58951676 0.55605718 1.40441560 Ni 10.76322506 12.58746421 1.79453818 28 0.32801636 -0.47621129 0.95192780 Ni 14.37432587 10.76596591 -0.00767422 28 -0.12018659 -0.30047021 -0.99958342 Ni 16.14878999 12.59205341 -0.01546353 28 -0.11920585 -0.28946952 -0.73944717 Ni 16.12833319 10.73665052 1.76440435 28 0.14943245 0.24710303 1.17427070 Ni 14.32991958 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Ni -0.00074471 5.34799142 5.35417435 28 -0.58757151 0.55291181 0.59585548 Ni 3.61946881 3.55971083 3.60223721 28 -0.47045271 0.66433280 -0.09053547 Ni 5.35109772 5.41875729 3.58379917 28 0.35548388 -0.59597315 0.28903435 Ni 5.39065108 3.57501179 5.34699430 28 -0.17416653 0.52973888 0.42829993 Ni 3.56263955 5.38270496 5.34437557 28 0.50859907 -0.11102245 0.38002551 Ni 7.15357493 3.58359753 3.57915843 28 0.29090821 0.32991401 0.22501223 Ni 8.94474440 5.40639180 3.62285682 28 0.56184786 -0.44726214 -0.54686831 Ni 8.98831416 3.61473482 5.36384074 28 -0.45805680 -0.13916203 0.13288460 Ni 7.18602065 5.40585438 5.36824118 28 -0.44816015 -0.70534226 0.31790917 Ni 10.78273143 3.59521674 3.54879566 28 -0.46821586 0.23505592 0.43753575 Ni 12.51470523 5.40217664 3.61117908 28 0.66779210 -0.40239121 -0.43252235 Ni 12.53040208 3.60473476 5.35332510 28 0.54420587 -0.23238242 0.45186596 Ni 10.76764765 5.35647581 5.41132023 28 -0.44358401 0.28348553 -0.39080797 Ni 14.37546345 3.63962614 3.56418767 28 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