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=2968.9777940046724 stress="-499.6617775664591 145.25919839722235 197.08587261248226 145.25919839722235 -443.37130647060536 58.90677357943536 197.08587261248226 58.90677357943536 -404.2251368147136" pbc="T T F" No -0.16778048 0.15110968 0.11686081 9540.23059471 -5045.64895513 -5817.51353356 No 1.77155237 1.43607246 0.01315282 -4375.37263261 6195.87263207 -2775.31895833 No 1.70278969 0.20646671 1.30938603 -6288.98522570 -2390.24975360 7483.50427709 No 0.03843313 1.47084216 1.65111220 1124.12726361 1240.02607666 1109.32821481