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=358.70967472189136 stress="-44.37693220212861 -2.460236429605476 5.018397730763742 -2.460236429605476 -86.13955869274858 -3.4576569227759526 5.018397730763742 -3.4576569227759526 -101.62969103241636" pbc="F F T" Hs 0.14695353 0.12431364 0.11229190 -398.21858358 -632.86464236 -317.53662172 Hs 1.74970532 1.55571451 0.12840100 366.13520493 1115.51975402 -355.75445579 Hs 1.71468376 0.25996555 1.58227526 363.17238602 -1052.00244628 306.91641639 Hs 0.02010853 1.65539708 1.43231773 -331.08900737 569.34733461 366.37466112