32 Lattice="7.429168229483643 0.0 0.0 0.0 7.429168229483643 0.0 0.0 0.0 7.429168229483643" Properties=species:S:1:pos:R:3:forces:R:3 energy=-61.01437438004115 stress="-0.00666649398838109 -0.0008398739692779169 0.00018031448874763936 -0.0008398739692779169 -0.00791639490374776 -0.0005737767762483572 0.00018031448874763936 -0.0005737767762483572 -0.00775363692961963" free_energy=-61.01437438004115 pbc="F F F" Ni 0.00507198 0.01950886 0.03409728 -0.20454433 -0.08822949 -0.16890610 Ni 1.87578554 1.83189147 0.01674190 0.30818144 0.73171073 -0.38707249 Ni 1.86046352 0.01697040 1.82218113 0.34838147 -0.45884774 0.91068376 Ni 0.00684936 1.86311220 1.88497655 -0.23794385 0.47813653 0.41929944 Ni 3.72933390 0.02747673 0.01896868 -0.38151611 -0.41046968 -0.39930985 Ni 5.55516247 1.85862789 0.01612399 0.20310231 0.46292563 -0.28500224 Ni 5.55230460 0.01600245 1.85196638 0.39643109 -0.27722972 0.47761453 Ni 3.70619349 1.82640951 1.88555232 -0.33852719 1.13345295 0.37283759 Ni 0.00518665 3.69752590 0.00967434 -0.20188017 -0.48899392 -0.32823109 Ni 1.86561984 5.55101337 0.01606546 0.22442266 0.40379255 -0.51115078 Ni 1.85249344 3.72457604 1.82910169 0.54813334 -0.96659097 0.98578569 Ni 0.02119638 5.53839214 1.83363498 -0.32072108 0.30937869 0.57480419 Ni 3.68679696 3.72084873 0.02914533 -0.12689952 -0.63143215 -0.34859035 Ni 5.57434434 5.58239033 0.01896539 -0.08816277 0.06382643 -0.03508612 Ni 5.60060509 3.71912576 1.82095773 0.07605794 -0.54434762 0.65884673 Ni 3.65807912 5.55975248 1.85811318 0.19430420 0.39823424 0.43166541 Ni 0.01086948 0.01887999 3.74634521 -0.03101746 -0.24748085 -0.56968011 Ni 1.89374535 1.88911429 3.69781538 0.37154020 0.31274862 -0.53910471 Ni 1.88654437 0.00435343 5.57643451 0.34346851 -0.12843361 0.12894882 Ni 0.03516735 1.86360659 5.53852668 -0.27397200 0.28340016 0.40044551 Ni 3.71759603 0.01391082 3.69959202 -0.43644757 -0.48823486 -0.28923724 Ni 5.58574083 1.85241282 3.74409107 0.36874443 0.54869124 -0.80605168 Ni 5.58486436 0.03367197 5.59956470 0.06927999 -0.19956595 0.03924078 Ni 3.74599345 1.83810055 5.54324758 -0.79852173 0.69277229 0.38175340 Ni 0.01114480 3.71088421 3.73834372 -0.32467292 -0.22559296 -0.74102852 Ni 1.88622469 5.57034948 3.69653070 0.09991061 0.21302417 -0.33641126 Ni 1.84298909 3.70998558 5.53516562 0.88493291 -0.49869721 0.39406672 Ni 0.04164280 5.56440239 5.59669618 -0.05806608 0.13079028 0.00383162 Ni 3.74951651 3.71687645 3.68168909 -0.70008391 -0.67378731 -0.41616500 Ni 5.57704691 5.53845504 3.71659732 0.15227034 0.21330526 -0.38688932 Ni 5.56305154 3.68651470 5.60523489 0.15296853 -0.18194797 0.15895498 Ni 3.69006754 5.55722574 5.55978182 -0.21915329 0.13369226 0.20913768