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=46.53744962325386 stress="-101.29256399264426 -16.68468928100791 2.9123566782038637 -16.68468928100791 -261.99634016625595 -155.04971554155424 2.9123566782038637 -155.04971554155424 -219.48594216821851" pbc="F F F" Nb -0.03487808 0.22586561 0.29391194 -45.03649916 -221.95983113 -178.70157190 Nb 1.22614529 1.52103145 -0.22238644 38.57663371 28.48107513 -35.37369113 Nb 1.53107505 0.11446132 1.52558823 34.50554222 -18.99320675 20.51034855 Nb 0.01459602 1.27538150 1.20296332 -28.04567676 212.47196276 193.56491447