4 Lattice="3.0 0.0 0.0 0.0 3.0 0.0 0.0 0.0 3.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=-114.92101587962365 stress="6.182236465993164 -0.19251871171191937 -1.6919658718843178 -0.19251871171191937 5.523240575327756 -0.9974905403284303 -1.6919658718843178 -0.9974905403284303 9.546283748906056" pbc="F F T" He 0.29874826 0.05835534 -0.25354363 62.47487908 57.74851177 -28.19987138 He 1.48193431 1.42001865 0.20070203 -64.06816066 -55.87348662 28.75635090 He 1.20342959 0.28187239 1.51001192 -82.41766386 64.38725545 10.48290392 He 0.10170120 1.37793365 1.21904386 84.01094544 -66.26228060 -11.03938343