16 Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-37.4002170515054 stress="7.101749696506644 2.638743240739096 1.570769017422478 2.638743240739096 8.23713311193392 6.062102697596872 1.570769017422478 6.062102697596872 6.202905333603117" pbc="F F F" Fe -0.22303573 -0.08338442 -0.03487808 1.28394126 1.33598577 0.89737495 Fe 1.72586561 1.79391194 1.22614529 -4.57462235 -4.72722088 2.54129358 Fe 3.02103145 -0.22238644 0.18220204 -0.67637154 1.30467606 0.74753492 Fe 4.39362841 1.92117662 1.48185114 0.90293933 -1.01545556 1.25092182 Fe -0.22461850 2.70296332 -0.15112699 1.30579781 -0.63990045 0.87668057 Fe 1.72083292 4.28984966 1.48735431 -2.93831125 2.74348362 -1.82218653 Fe 2.92299150 2.90698366 0.18107110 2.33971164 2.58998745 -4.42109957 Fe 4.40153258 4.63102478 1.59995250 -0.53272221 -0.63017334 0.83069841 Fe 0.26120756 0.01193751 3.25226748 1.09925016 1.26243585 -0.91940396 Fe 1.46431997 1.74386224 4.70197342 1.10022308 -0.59840665 -0.59335687 Fe 3.20379337 0.11280455 2.76922180 -0.99981009 1.25845089 0.20909325 Fe 4.28229695 1.52031036 4.68745344 -0.96851410 1.13307352 -1.29597657 Fe 0.02015752 2.87970777 3.27711528 -0.91685456 -1.47817301 -1.85919536 Fe 1.37871118 4.25213077 4.23125112 1.40233382 1.45884352 1.18294374 Fe 2.71824351 3.13616082 2.76429260 3.40653866 -2.54515076 3.92921700 Fe 4.62968218 4.71980528 4.79977655 -1.23352967 -1.45245604 -1.55453935