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=-6.873885757864567 stress="-0.0741389155191767 -0.03435632725507017 0.04670238153828379 -0.03435632725507017 -0.01726194684101223 -0.029513145297575212 0.04670238153828379 -0.029513145297575212 -0.15209751884462916" pbc="F F T" N 0.24122900 0.03484569 -0.18365652 0.20976557 -0.71494121 -1.37545128 N 1.25392277 1.48566276 -0.18556893 2.61932909 0.33009872 -1.75355442 N 1.54376171 0.19273990 1.45443740 -0.79334585 0.44661083 0.73992348 N 0.05332204 1.38436473 1.73110688 -2.03574881 -0.06176835 2.38908223