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=-22.163876805076406 stress="0.1873068074772588 -0.8590504902145334 1.79124616254252 -0.8590504902145334 1.59838893372409 -0.6113696139350271 1.79124616254252 -0.6113696139350271 -2.0050467362189264" pbc="F F F" H -0.08261918 0.15093924 0.14803915 0.20282558 0.18201129 -0.18717456 He 1.26416454 1.64526935 0.03806039 0.93496411 -0.46738965 -1.23095210 H 1.57797747 0.26599513 1.67918122 -0.84609537 0.95359836 -0.22067546 W 0.05957798 1.66192607 1.49509235 -0.29169431 -0.66822000 1.63880212