32 Lattice="42.0 0.0 0.0 0.0 42.0 0.0 0.0 0.0 42.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-68.62843715356951 stress="-0.0015267048038714376 0.0001239257581550144 -2.0335432612462713e-05 0.0001239257581550144 -0.0013858915378230634 5.5895612293011966e-05 -2.0335432612462713e-05 5.5895612293011966e-05 -0.0014719526399034845" free_energy=-68.62843715356951 pbc="F F F" Ni 20.92001865 21.20070203 20.70342959 -0.62081865 -1.41322743 -1.18043647 Ni 22.40085166 22.69783270 21.28187239 -1.12248378 -2.57576566 -5.81171928 Ni 22.51001192 20.98453339 22.60170120 1.20179735 -7.88249196 -4.75147385 Ni 20.87793365 22.21904386 22.63043801 -6.73597625 3.45649413 -2.61606070 Ni 24.24624097 21.14302402 20.85498893 -2.91175092 -2.55022415 -4.17309038 Ni 25.61042859 22.70947124 20.85512851 4.03298017 -0.71021669 -3.89513750 Ni 25.55280714 20.91333883 22.22081350 4.50842794 -1.64852008 0.94632401 Ni 23.87241235 22.32230844 22.41049160 4.30655194 -2.36953334 0.50892083 Ni 20.88006827 23.70422919 20.75205420 -2.27157642 1.97977322 -0.98937076 Ni 22.65488783 25.44496141 20.70245745 -1.81501649 1.05112066 -1.31850488 Ni 22.66431082 23.81425730 22.48844065 -6.34243149 3.95461900 1.07746422 Ni 21.03277713 25.39971974 22.67134590 -1.92771746 1.30604193 -2.40445376 Ni 23.94371364 23.78219307 21.21813893 0.36186870 1.34642216 -7.98790648 Ni 25.12781736 25.69410236 20.83096497 1.62678695 1.34250038 -2.25334037 Ni 25.38201197 23.93300593 22.22002482 6.55196157 1.11916285 3.71416508 Ni 23.94786038 25.41661558 22.46512192 0.12806334 5.39327357 -0.75277835 Ni 21.22586561 21.29391194 23.69625653 -5.19185690 -6.17361157 1.41423051 Ni 22.52103145 22.27761356 23.88440523 3.00530642 3.37980515 5.02795010 Ni 22.39362841 21.23573857 25.52724172 3.12394244 -3.28255710 3.49387213 Ni 20.77538150 22.20296332 25.34887301 -4.39283241 1.61175621 3.39758760 Ni 24.22083292 20.78984966 23.70491316 -0.78589862 -4.42691189 3.08437166 Ni 25.42299150 22.40698366 24.18107110 4.76690043 2.03231863 -3.30406715 Ni 25.32825321 21.13102478 25.59995250 2.25799788 -4.43533455 2.63983828 Ni 24.26120756 22.51193751 25.75226748 -4.11088560 2.79634119 2.98904943 Ni 20.96431997 23.89937931 24.07236142 -2.34943153 0.39671251 -0.83405034 Ni 22.70379337 25.73854596 23.76922180 -1.52105353 2.47322381 3.81521714 Ni 22.28229695 24.02031036 25.68745344 3.62429236 -2.43990687 1.58999037 Ni 21.02015752 25.37970777 25.67628676 -1.58004068 2.86729937 0.18910089 Ni 23.87871118 23.75213077 23.73125112 1.65608417 2.02135276 6.58640654 Ni 25.21824351 25.63616082 24.02664599 3.37428000 1.88960629 -2.04649165 Ni 25.62968218 24.21980528 25.64815751 3.02767749 -1.86207064 1.06487352 Ni 24.18543805 25.45460942 25.57327937 -3.87514840 1.35254812 2.77951962