256 Lattice="14.476177215576172 0.0 0.0 0.0 14.476177215576172 0.0 0.0 0.0 14.476177215576172" Properties=species:S:1:pos:R:3:forces:R:3 energy=-738.0144952007352 stress="-0.006381624134064194 -0.00040745585284327043 -0.0006091156488835466 -0.00040745585284327043 -0.006186882748398014 0.0004652083998160339 -0.0006091156488835466 0.0004652083998160339 -0.006354759564741153" free_energy=-738.0144952007352 pbc="F F F" Ni 0.02373308 0.02071469 0.01907125 -0.52090744 -0.57941929 -0.50219907 Ni 1.78744951 1.80178358 0.00340982 0.95668272 0.66514593 -0.81440914 Ni 1.77709161 0.00820227 1.84155633 1.16091906 -0.75258919 0.32830808 Ni 0.01881858 1.80016678 1.80203434 -0.96498338 0.85892352 0.72556213 Ni 3.59363895 0.00329148 0.03124769 -0.18089353 -0.60238720 -0.55419442 Ni 5.40446593 1.77445959 0.00174551 0.32403036 1.07966982 -0.71240064 Ni 5.41201142 0.00922041 1.78495168 0.28434553 -0.74020594 1.12925483 Ni 3.65372848 1.82213550 1.82405819 -0.23632076 0.83885870 0.96611516 Ni 7.26836857 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12.63925034 -0.25768838 0.00348122 0.70557797 Ni 7.28378097 5.46445780 12.65519326 -0.32874815 -0.42863152 0.73650073 Ni 10.86635845 3.58580267 10.86050352 -0.61448145 0.86766915 -0.79543924 Ni 12.68094243 5.46132062 10.87958749 0.68636113 -0.47932992 -0.98355923 Ni 12.65004711 3.60667003 12.69093214 0.49777996 0.13666813 0.37073855 Ni 10.86037535 5.45133938 12.65951463 -0.62979540 -0.45984711 0.71555700 Ni 0.02816073 7.25476132 10.88561819 -0.87292027 -0.25420270 -0.98100810 Ni 1.79165992 9.07622694 10.85833830 1.24314185 -0.47327608 -0.83538847 Ni 1.78780181 7.20805126 12.67519454 1.11604740 0.13105050 0.53561409 Ni 0.00567034 9.02473746 12.64570257 -0.57008417 0.21674058 0.75809737 Ni 3.65497999 7.26208672 10.86782941 -0.55328328 -0.40185574 -0.98120332 Ni 5.45794187 9.06907720 10.84155684 -0.06042198 -0.21083339 -0.52579267 Ni 5.40085168 7.21444302 12.68971177 0.35855581 0.34967213 0.40599921 Ni 3.61445121 9.06139672 12.63525271 -0.08884897 -0.13375215 0.63274480 Ni 7.24052748 7.20845228 10.87309442 -0.13663161 0.56459008 -1.07016841 Ni 9.06962508 9.04223455 10.86252544 -0.67230397 -0.02258547 -0.89651585 Ni 9.07278617 7.22653163 12.64217543 -0.16852133 0.38354569 0.68869234 Ni 7.20539736 9.04460325 12.70243367 0.45226946 -0.17581776 0.26682027 Ni 10.88300136 7.19774178 10.89282081 -0.99894456 0.47106005 -1.43230538 Ni 12.63054430 9.07929220 10.83039567 0.96248835 -0.38716375 -0.22402271 Ni 12.66285117 7.24900939 12.63590780 0.62536804 0.37337299 0.81163921 Ni 10.83613709 9.09652736 12.66469021 -0.25132211 -0.43259584 0.70632541 Ni 0.02719423 10.87890879 10.87628158 -1.10527559 -0.49803179 -0.82434078 Ni 1.82141334 12.67683572 10.85970612 0.39485702 0.87703610 -0.85667749 Ni 1.78037522 10.89259527 12.63835741 0.71562414 -0.92019852 1.16223554 Ni 0.00254601 12.69649023 12.70012761 -0.30395038 0.35288277 0.21643595 Ni 3.61630788 10.87504746 10.86877604 0.03037811 -1.16299915 -1.20157120 Ni 5.41010316 12.63417588 10.87364787 0.15181812 0.96966008 -0.46926922 Ni 5.42351514 10.84243612 12.68724546 -0.10180942 -0.54230281 0.71649078 Ni 3.60301234 12.63361912 12.66363370 0.17056869 0.72149574 0.74462957 Ni 7.22486213 10.88176757 10.89287807 0.28961774 -1.31242608 -1.09360387 Ni 9.07723708 12.64686891 10.88493879 -0.31508996 1.03539828 -0.78003479 Ni 9.08379057 10.88333451 12.63175152 -0.56437510 -0.94729908 0.94669511 Ni 7.22622357 12.64478861 12.67955639 0.04919437 0.64286083 0.56883643 Ni 10.87174526 10.85936748 10.84116675 -0.53964549 -0.36149364 -0.67372761 Ni 12.69717413 12.68732924 10.89022361 0.35078596 0.38093981 -0.73203244 Ni 12.69984014 10.86030490 12.69151120 0.46041638 -0.49784074 0.43278599 Ni 10.86370080 12.65211536 12.66047502 -0.20152335 0.68727453 0.73067929