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=128.30702460699035 stress="-0.009956845815255086 2.0570635263169415e-05 0.00020955618832745228 2.0570635263169415e-05 -0.010063460493933989 0.00015768770176808122 0.00020955618832745228 0.00015768770176808122 -0.01021773410948672" free_energy=128.30702460699035 pbc="F F F" Ti 21.01684590 21.01299468 20.86164825 -17.05024807 -14.03016280 -15.55841393 Ti 22.48187718 22.45291772 20.87779858 -5.09716291 9.56812291 -25.65003545 Ti 22.35089236 21.14937413 22.38645486 16.35812286 -31.13227181 7.26230665 Ti 20.94045093 22.43068330 22.52917767 -33.78339361 10.72197163 -7.91419158 Ti 23.87322818 20.99096715 20.96000932 5.42430212 -21.77243898 -16.80961470 Ti 25.60035101 22.35171479 20.95042583 17.89231292 7.05667004 -26.52373822 Ti 25.49896774 21.14093619 22.44485985 18.66986772 -32.48138420 2.48700861 Ti 24.13082434 22.55085060 22.43896683 -13.37096711 -6.78500913 5.39665150 Ti 20.85952193 24.00041301 21.12312049 -15.44595268 -5.45803152 -21.78828706 Ti 22.57151201 25.42749447 21.05521430 -11.07318930 20.20997949 -27.17546092 Ti 22.60473562 23.92756425 22.52640357 -10.52702031 2.94294408 -6.00357485 Ti 20.95666942 25.42327745 22.43620618 -18.34882456 21.13033236 4.68636073 Ti 23.91115422 23.89460139 20.86143210 9.60301959 -0.03960948 -26.18030670 Ti 25.46929036 25.37602710 21.07744391 15.28079582 11.06766656 -13.13400738 Ti 25.52994270 23.85122873 22.58215541 27.81426088 11.58835388 -3.46772809 Ti 23.90712865 25.49422032 22.39245395 10.23305391 26.54396494 12.05678620 Ti 20.94985987 20.93683068 23.84611393 -17.19795710 -27.02667577 4.53710231 Ti 22.39109654 22.60906946 23.88358035 12.81139016 -10.10580384 13.07426907 Ti 22.59705118 20.91548249 25.44100599 -5.33056273 -15.86849784 18.81078590 Ti 20.96650296 22.21913417 25.38848213 -16.56278885 3.94286671 23.56120437 Ti 24.02638820 20.98256096 24.11293281 -8.34001145 -25.55200206 -23.01013034 Ti 25.64695597 22.36307265 24.01051572 27.65043647 5.86540760 -4.57816817 Ti 25.38880678 21.09110102 25.44681420 25.07930315 -25.74471395 27.62476426 Ti 24.11786929 22.51362086 25.38769075 -17.91162636 12.94980212 26.04900277 Ti 20.85148166 23.92443650 24.11041646 -29.74566322 4.36023452 -2.08454437 Ti 22.27707113 25.49367715 24.02633684 7.62083742 28.13285758 -7.10086770 Ti 22.45349183 24.09053555 25.41412661 6.31315614 -11.18024866 30.22164160 Ti 21.06551239 25.54997625 25.63060378 -16.62724416 14.17696503 16.49993463 Ti 24.00596876 24.12613374 23.98215999 0.99984116 -2.87577161 3.69104370 Ti 25.52198250 25.53618071 24.10189669 20.98300830 19.52335274 -9.58618271 Ti 25.61927298 23.88461090 25.39114848 19.81961517 4.91756310 20.21334515 Ti 24.12005782 25.59372672 25.51007876 -6.14071136 15.35356634 20.39304470