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=-17.213693845974063 stress="-10.359313172657309 0.11373138341175332 0.8912824897708482 0.11373138341175332 -10.880156673315437 2.2335674836000203 0.8912824897708482 2.2335674836000203 -6.5872602323475595" pbc="F F F" W -0.18556893 0.04376171 -0.27948471 -3.05012726 -2.77868455 -0.64544716 Re 1.69273990 1.30722932 -0.23827333 3.61169672 3.91648182 -2.70212978 Re 1.55332204 -0.11563527 1.73110688 2.36541814 -4.66899790 2.29500508 W -0.00183978 1.51283276 1.70071341 -2.92698760 3.53120062 1.05257186