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=16.38941890452375 stress="-0.00743369883261214 -0.00016585732300781239 -5.775526087430012e-05 -0.00016585732300781239 -0.006550155830980613 0.0009381214423993524 -5.775526087430012e-05 0.0009381214423993524 -0.00802387364875359" free_energy=16.38941890452375 pbc="F F F" Ni 21.24379340 20.81973574 21.18183154 -4.58104294 0.31517013 -5.55275080 Ni 22.54963065 22.70070203 20.86063365 0.45997863 -11.72006897 -12.18777121 Ni 22.40085166 20.76358393 22.78187239 -9.40695265 -7.38037265 -21.93454127 Ni 20.89508793 22.78221793 22.58443811 -6.03019659 -25.26207163 24.03038282 Ni 23.73859032 20.88993997 20.97093726 0.63967346 -1.92053479 -0.50681142 Ni 25.44844415 22.36058287 20.71040324 5.56335549 -5.30483109 -1.75745471 Ni 25.50960007 21.20947124 22.61748189 2.57238070 -10.44736688 -10.59816696 Ni 23.90118810 22.62339238 22.55867222 64.21825281 -17.48080645 -45.59046208 Ni 20.87241235 23.77199534 21.20643832 -10.76328374 13.65261149 -43.18647793 Ni 22.37996880 25.42900927 20.75205420 -0.36449931 4.41631548 -7.97602827 Ni 22.65488783 24.05988540 22.20245745 -4.02259880 7.31193967 -5.93191829 Ni 21.16431082 25.17112928 22.46508478 -13.54485581 21.74710218 13.14348112 Ni 24.27400614 23.92173267 20.87366136 -29.52371999 -14.39158450 -32.06607201 Ni 25.46097674 25.28219307 21.21813893 36.39016577 58.57912087 -51.00396647 Ni 25.26716069 24.19410236 22.33096497 22.12152708 -70.23469088 44.12746875 Ni 23.88201197 25.43300593 22.22002482 -15.35264716 32.60039162 10.73407219 Ni 20.82072597 21.10935549 23.77235124 -12.42060018 -0.05574911 10.22685022 Ni 22.72586561 22.79391194 23.48787197 -57.67346151 -20.76623028 56.40962215 Ni 22.57435349 21.00872044 25.68036226 -1.38411946 -0.21419088 0.00514629 Ni 20.90646116 22.73573857 25.52724172 -8.90174484 -25.30321161 30.02306971 Ni 23.77538150 20.90367673 23.84887301 24.27817098 -1.17887372 20.48423159 Ni 25.54941328 22.43705773 24.07677774 9.02480307 16.95647812 -11.43253929 Ni 25.38005574 21.18258347 25.39428823 2.93227705 -20.24483038 15.91398496 Ni 24.04561766 22.63102478 25.59995250 -16.16014025 -32.85474459 25.43732862 Ni 21.26120756 23.79798530 24.25226748 -22.08893246 27.68003381 -36.71135716 Ni 22.66816129 25.54396501 24.07236142 -0.55382319 11.57428890 -6.30143728 Ni 22.70379337 24.03079219 25.26922180 -15.11444906 2.68710604 45.02797936 Ni 20.78270720 25.37475659 25.67934225 -0.11380234 0.78903395 0.62206871 Ni 24.08498449 23.87970777 24.27711528 -24.80253175 10.17502595 -81.91525844 Ni 25.37871118 25.25213077 23.73125112 9.33033098 28.21760029 18.95988681 Ni 25.21824351 23.98236142 25.26429260 83.33582824 10.01472096 51.01872386 Ni 24.14789600 25.42555953 25.76940878 -8.06334223 18.04321897 8.48871646