32 Lattice="6.758245468139648 0.0 0.0 0.0 6.758245468139648 0.0 0.0 0.0 6.758245468139648" Properties=species:S:1:pos:R:3:forces:R:3 energy=-83.5345990086 stress="-0.6699099492813837 0.016164703115860882 0.06847936784843187 0.016164703115860882 -0.4442533780391384 -0.0014396514916102468 0.06847936784843187 -0.0014396514916102468 -0.5101384054443044" pbc="F F F" C -0.12049575 0.09262900 0.09204096 1.09230984 1.31983185 1.32890085 C 1.89230594 1.55408125 -0.13472070 0.14921841 0.10269975 -2.28864441 C 1.28255507 -0.13741853 1.77636847 -1.44819678 -0.88323142 0.16584592 C -0.18489349 1.70521874 1.54651513 -3.62831182 -0.45919231 -1.20758975 C 3.19798064 0.21474705 -0.02041365 0.68587009 -0.51531064 -2.25889421 C 5.02363673 1.44677756 -0.06345212 0.21108335 -1.11705473 -0.48809862 C 4.89203926 0.18564236 1.84443117 0.34319117 -2.56939986 -0.79522492 C 3.53214615 1.85274404 1.81193644 0.05473820 1.56346422 0.79348021 C 0.22466171 3.31472165 0.04560568 -3.46429625 -3.42417971 0.05112565 C 1.86453087 5.06207685 0.12750193 -1.40866484 7.68154761 -4.72873863 C 1.72163067 3.34391156 1.37452067 -3.21832160 -4.70425128 -1.91971227 C -0.03508886 4.89294117 1.49652095 -2.99305534 1.32597533 0.90933925 C 3.53894456 3.76314571 0.24284059 4.59013602 -1.66328121 -7.88399257 C 5.17248869 5.09579728 0.11131691 1.54663913 0.13820802 -1.45322763 C 4.88611098 3.55228452 1.55953939 8.68378497 -5.42313001 -0.34140200 C 3.21743961 4.91999742 1.70090802 -5.49809505 10.51576866 6.36358698 C -0.12334412 -0.01958214 3.63707293 -2.88801176 -3.58405609 -1.09468542 C 1.63744005 1.62413853 3.25370875 1.28170925 2.08958921 -1.76093898 C 1.64930869 0.04239853 4.91591858 0.70495619 -2.84981740 2.48642920 C -0.02277410 1.40398162 5.01642907 -2.08702454 1.90550710 2.88248148 C 3.60595576 -0.05515562 3.48856373 0.89504186 -4.38069165 2.29824776 C 5.28517301 1.46116564 3.19999552 6.17267996 2.88646617 3.60696256 C 5.22173174 0.06274965 5.13821186 -1.08035906 0.40070653 -1.58712841 C 3.06092479 1.57171648 5.02185836 0.27419097 0.50729283 0.63799513 C 0.14191349 3.32408730 3.23065188 0.14500933 -1.32062605 -1.73298016 C 1.86638848 5.00606222 3.48737828 1.97094427 2.38748846 -2.77603264 C 1.50806512 3.74384757 5.12043410 -4.44517976 0.71595667 2.36724123 C 0.11135716 4.97444645 5.12730435 -2.43670553 0.24969881 4.09996435 C 3.17160789 3.42473523 3.30879830 0.09263000 -3.17548945 0.32419231 C 5.18253089 4.83456546 3.26715248 3.28226665 -0.58107555 -0.29733665 C 4.92824009 3.38757149 4.76953199 0.28825105 0.93458253 -0.56006743 C 3.20938205 4.85325606 5.14044750 2.13157162 1.92600360 4.85890184