32 Lattice="63.55206871032715 0.0 0.0 0.0 63.55206871032715 0.0 0.0 0.0 63.55206871032715" Properties=species:S:1:pos:R:3:forces:R:3 energy=-156.75514043884547 stress="0.0002959339173927775 -7.12535250100859e-07 1.573760646266016e-05 -7.12535250100859e-07 0.0003125311267896348 -2.799923827564913e-06 1.573760646266016e-05 -2.799923827564913e-06 0.00030387198227432817" free_energy=-156.75514043884547 pbc="F F F" Zr 31.77672270 31.98123517 31.89522104 1.18099985 0.45042560 0.42163740 Zr 33.92490854 34.13777492 31.95059372 0.56677306 -0.01478813 -0.57592333 Zr 33.92502485 31.82004030 33.72536944 0.23009650 0.30476273 1.00210476 Zr 31.64816344 33.93942806 33.66230717 0.08696910 1.05644107 1.53708016 Zr 36.24087750 31.54508786 31.72485163 -0.36673259 2.72560081 2.03547423 Zr 38.37856308 34.05433621 31.82593886 -1.46948379 0.10743352 1.27138137 Zr 38.33723245 31.91296004 33.80694174 -1.10488205 1.10076154 0.59709943 Zr 36.30583504 34.07306537 33.96218421 0.30388719 -0.34426878 0.57022249 Zr 31.67075215 36.50157627 31.59452858 2.20968409 -0.73628131 2.74391843 Zr 34.22753353 38.39115182 31.93778632 -1.62821293 -0.53375512 0.53447851 Zr 33.77853938 36.21714448 34.16496732 1.09192744 0.87326751 -1.91261214 Zr 31.54272170 38.39932146 34.15302851 2.02389272 -1.41139464 -0.30259216 Zr 36.28640277 36.50368918 32.02096097 0.68338389 -1.70339537 -0.68892297 Zr 38.35697232 38.60271078 31.59071232 -1.62055077 -2.07836184 2.42871903 Zr 38.73701961 36.22682484 34.24219990 -1.16973686 0.81187176 -0.81943500 Zr 36.33816926 38.39800249 33.79822053 0.68653760 0.61026474 2.22415979 Zr 31.65009519 31.96006179 36.14034255 2.39678055 2.39111532 -0.20195010 Zr 33.99328543 33.98157734 36.23795422 -0.12239880 -1.13261540 1.31368688 Zr 34.44326595 31.63291203 38.69437189 -0.02847672 2.82311136 -2.33913280 Zr 31.85932810 34.26342406 38.59513250 2.04854764 -0.71345433 -2.29045125 Zr 36.52569074 31.74630100 36.48302583 -0.63482191 0.72739057 -0.48860889 Zr 38.64548576 34.21557890 36.50627991 -0.59844382 -0.90649909 -0.36287747 Zr 38.39286941 31.59461515 38.60210987 -1.73438118 2.37382435 -1.81578507 Zr 36.47167903 34.06254903 38.36566771 -0.90606005 -0.31215532 0.31075458 Zr 32.00696375 36.19493059 36.10891014 -1.21330644 0.20052720 2.06801069 Zr 33.82179370 38.55141167 36.42893519 0.77014755 -0.38621349 -0.46351867 Zr 33.84932826 36.44188043 38.76835564 0.60100420 -0.24798387 -1.24490586 Zr 32.02584814 38.73971628 38.54735909 1.31628142 -2.26773987 -1.59621323 Zr 36.22348687 36.41983420 36.41153013 0.58707123 0.38837616 -0.25319469 Zr 38.48040007 38.71618796 36.12017489 -2.13772493 -2.38831842 0.47875251 Zr 38.48941458 36.40889751 38.57079866 -1.78530502 0.48709320 -1.97356269 Zr 36.23581648 38.72759800 38.56027727 -0.26346617 -2.25504245 -2.20779391