16 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=557.8961941944891 stress="-0.06001095717968979 -0.017161989006819662 -0.01334156861194942 -0.017161989006819662 -0.0544450081148784 -0.013416963864021162 -0.01334156861194942 -0.013416963864021162 -0.05726548541095711" pbc="F F F" Re 21.27006960 20.94887211 21.11414525 -12.45602860 -11.22283754 -7.32703106 Re 22.65179000 22.71834221 22.71978899 -405.24801738 51.85261618 -180.12071672 Re 24.17190704 21.16063057 20.92085186 -844.92106107 -737.92187099 -919.29490531 Re 25.44127420 22.22446291 22.26162479 1031.48091275 595.51094714 962.58989180 Re 21.05735001 23.99179060 20.94822544 -33.78055703 -4.84817886 -30.37925249 Re 22.65289348 25.78169637 22.26264440 -61.39663646 105.13488527 36.73261049 Re 24.09613256 23.95194006 21.21674821 48.11232083 195.83617075 -317.04090586 Re 25.55786780 25.52428464 22.89212924 483.30613787 423.10445285 -374.22626465 Re 21.22811156 21.00514875 24.19482935 -240.82998881 -152.56995346 -101.07989189 Re 22.50312502 22.40807186 25.70779463 127.57585670 114.83142886 183.02655609 Re 23.73966369 20.95658891 23.78277192 262.83120121 -357.28816485 189.00194232 Re 25.65506403 22.71792819 25.29167805 52.84984613 -187.86121088 28.02171897 Re 20.89014994 24.00511536 24.25282429 -96.08595379 12.10038986 -36.34430985 Re 22.80042881 25.23494148 25.52970803 -324.80007837 317.23323710 460.53038614 Re 24.06131881 24.22739506 23.94504073 -262.47119932 -664.78504032 -238.64266778 Re 25.51066455 25.20365970 25.48404612 275.83324536 300.89312889 344.55283979