32 Lattice="54.4600021362305 0.0 0.0 0.0 54.4600021362305 0.0 0.0 0.0 54.4600021362305" Properties=species:S:1:pos:R:3:forces:R:3 energy=-85.65479237374439 stress="8.415774271394768e-05 1.2573428686969635e-05 -1.4553667893016264e-05 1.2573428686969635e-05 7.133400134490142e-05 -3.026697811337794e-05 -1.4553667893016264e-05 -3.026697811337794e-05 8.388961314877899e-05" pbc="F F F" Pd 27.10950531 27.32263006 27.32204203 1.02729730 0.38542553 0.53025964 Pd 29.34966923 29.01786323 27.09528037 -0.56622582 0.55601655 1.29535838 Pd 29.02665760 27.09258254 29.29201295 0.17186380 0.60939647 -0.63191753 Pd 27.04510758 29.21231632 28.80136866 1.26234840 0.23812835 0.68482733 Pd 30.98712490 27.19579123 27.39882932 0.23480208 0.66857278 0.76035431 Pd 33.11920237 28.93221734 27.11791950 -1.28043104 0.28783063 1.17608983 Pd 32.80988598 27.41564343 29.32987095 0.60261103 -1.70182404 -2.38461428 Pd 31.27302464 29.33818381 29.29737622 -2.27586778 -1.57399423 -1.68716698 Pd 27.45466278 31.26688650 27.10835506 0.51362347 -0.94955826 0.47297708 Pd 29.34997065 32.85472501 27.10899026 -0.30188805 -0.05333133 0.55776236 Pd 29.20707044 31.08479004 29.35605934 0.14657561 -0.51798870 -3.15263555 Pd 27.19491220 32.97188198 28.79443927 1.04330029 -0.52965839 0.52080026 Pd 31.27982304 31.26913054 27.47284166 -0.75506170 -1.27011930 -2.19715088 Pd 33.16046262 33.09211448 27.35420681 -0.79661130 -0.58707884 0.88009726 Pd 32.88242818 31.10916356 29.14670112 2.72355641 0.44421694 0.40979135 Pd 30.95831809 32.91631461 29.18634780 0.69550431 1.78833640 0.20290783 Pd 27.10665695 27.20973058 31.05722277 0.80219534 0.96775544 -0.01521309 Pd 29.17150928 28.99039163 30.90414343 -0.27617325 -0.07528667 1.38669196 Pd 29.02766990 27.09784023 32.91223577 0.13390131 1.03886661 -0.96534278 Pd 27.16322102 28.89498791 33.14061718 1.28209992 0.15534547 -1.21760940 Pd 31.34683424 27.17484545 31.22944222 -1.66787870 0.07769532 1.05616423 Pd 33.03434819 28.94660541 30.94087400 1.03572545 2.09411771 2.76319010 Pd 33.21804894 27.39907376 33.13452905 -1.06122338 0.79327829 -0.84746287 Pd 30.86725596 29.13002616 33.24912206 0.07898437 -0.03579827 -1.43971024 Pd 27.65799094 31.27158728 30.97987363 -2.65265257 -0.81223493 0.93505492 Pd 29.35182825 33.00237942 31.22825677 -0.22222489 1.52117569 -0.42427733 Pd 28.99350490 31.35565287 33.10386246 1.20331379 -2.66221225 0.49416331 Pd 27.42610923 32.92085914 33.12362155 -0.52770895 0.70056328 -0.43571047 Pd 31.16043850 31.16561371 31.04967679 -0.67634946 -0.65228694 1.03971312 Pd 33.17884809 32.98566824 30.91594180 -1.00263595 -0.50662235 0.01086710 Pd 32.66311290 31.21201686 32.87113139 1.00219105 -1.02206348 0.27300494 Pd 30.98277993 32.85026161 33.13676470 0.10303890 0.62333652 -0.05126391