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=-32.33298559848569 stress="-0.035126345174835656 -0.21905507415876838 -0.06598139841083342 -0.21905507415876838 0.39354395282017307 0.09872567704346061 -0.06598139841083342 0.09872567704346061 -0.13018014683324453" pbc="F T F" He 0.15075815 -0.06703053 0.10260142 -1.21786306 0.12164754 -1.07265530 H 1.64300289 1.20314191 0.13185401 -0.13990632 1.51657595 -1.80983835 W 1.47839446 -0.16941539 1.36537308 0.91435644 2.36445100 3.33269284 H 0.02278034 1.68407183 1.52557968 0.44341294 -4.00267449 -0.45019919