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=31346.706158899076 stress="-4868.98631208134 534.5145502572732 741.9757888053034 534.5145502572732 -4138.793096584231 703.7738664462646 741.9757888053034 703.7738664462646 -5147.369011032524" pbc="F F T" Nd 0.14217002 0.01140844 -0.02960715 -32512.88542668 -28708.05593957 -21502.11554833 Nd 1.58029288 1.64622330 0.23937201 41842.98516708 34640.10557967 -40315.89044795 Nd 1.50190319 0.03647120 1.35338472 51806.44714707 -46835.45393036 28247.80820947 Nd 0.12835943 1.38760392 1.41450119 -61136.54688747 40903.40429026 33570.19778681