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=23.356359205602068 stress="-158.71087184433333 19.574924750014247 29.322177922354008 19.574924750014247 -129.36723198913415 30.816131330094407 29.322177922354008 30.816131330094407 -174.20355192681603" pbc="F F F" Nb -0.04225341 -0.08147842 -0.04210664 -31.17365704 -39.45067767 -17.05424433 Nb 1.38825682 1.27041603 0.19178619 74.97499736 57.51728113 -115.73120778 Nb 1.67895518 0.29140871 1.61455359 33.24440934 -61.04325459 76.71288379 Nb 0.03253581 1.64904689 1.28091226 -77.04574965 42.97665113 56.07256832