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=0.8717515427819226 stress="-0.4727767310198244 0.3958963689838302 -0.3210664207973305 0.3958963689838302 -1.8421681563838788 1.3692108749653797 -0.3210664207973305 1.3692108749653797 -2.178684443886703" pbc="F F F" H -0.25913830 -0.16114480 0.03926819 -0.04498756 -0.16539994 -0.24787477 He 1.53464144 1.59566688 0.12528982 -0.13685510 1.00757982 -1.12349805 W 1.62033173 0.17828948 1.71182891 0.38788109 -1.18170607 1.23944162 H -0.20698176 1.23241985 1.57255377 -0.20603843 0.33952620 0.13193120