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=109.62294656729064 stress="-13.193293314358858 0.22463995010654225 -0.12284722853406346 0.22463995010654225 -13.259652944457676 -0.06885515782313505 -0.12284722853406346 -0.06885515782313505 -13.31539502985917" free_energy=109.62294656729064 pbc="T T T" Ge -0.14459490 0.11115480 0.11044915 4.60155510 -16.35809064 -7.03759187 Ge 1.70960170 1.31143450 -0.16166483 -24.26366844 11.97244935 5.33385650 Ge 1.16509000 -0.16490224 1.64041416 9.51822881 2.53080528 -8.12115195 Ge -0.22187219 1.47773705 1.32834452 10.14388452 1.85483601 9.82488732