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=46.83745415798592 stress="-3.5946936642297462 0.06321315704362761 0.3634941245961749 0.06321315704362761 -4.60965464330301 1.335506084866742 0.3634941245961749 1.335506084866742 -5.565223480005208" free_energy=46.83745415798592 pbc="F F T" Cd 0.05835534 0.20070203 2.70342959 -38.24159620 -41.52579223 14.46319470 Cd 1.40085166 1.49793547 0.28187239 37.06938606 47.77664587 -19.81272824 Cd 1.51001192 0.10170120 1.37793365 31.38026821 -43.86890554 11.32526324 Cd 0.00082602 1.74624097 1.64302402 -30.20805806 37.61805189 -5.97572971