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=-1.2658796469285118 stress="0.1065802842278944 -0.019195091618554923 -0.01203492207018698 -0.019195091618554923 0.055730326093703084 0.006607617568199637 -0.01203492207018698 0.006607617568199637 0.11590283967397129" pbc="T F T" user11 0.18339760 0.29569533 -0.11032904 0.58790186 0.56711001 -0.50154489 user11 1.78645352 1.56738183 0.10055381 0.26207566 -0.52616266 0.19059742 user11 1.20501814 0.15758571 1.77753224 -0.90689928 0.66743263 0.62910711 user11 0.06079374 1.34516877 1.26765087 0.05692176 -0.70837999 -0.31815964