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=17.53782019932748 stress="-2.781969630448429 0.028825466262161863 0.11594178993967691 0.028825466262161863 -2.4326282240345347 0.19774459203441508 0.11594178993967691 0.19774459203441508 -2.4195328585907903" free_energy=17.53782019932748 pbc="T F F" V 0.03099333 0.19045800 0.07166715 -12.74803711 -25.55725929 -20.37400253 V 1.42588762 1.21223271 0.17379638 15.41728099 33.32108599 -28.03960309 V 1.40411058 0.03320948 1.44057204 8.45887972 -27.72988838 28.11237742 V 0.20040666 1.55646809 1.53502127 -11.12812360 19.96606168 20.30122820