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=24.01125933542016 stress="-3.10391202168822 0.5744328363141001 0.045781961352637644 0.5744328363141001 -3.276335987129106 -0.2584519276367139 0.045781961352637644 -0.2584519276367139 -2.607778036265669" free_energy=24.01125933542016 pbc="T T F" Mo 2.70865944 2.86550211 0.22277084 4.12978551 -0.61815945 -22.27932924 Mo 1.68584377 1.83663041 0.19581920 -4.67019929 -3.79878628 -28.37675002 Mo 1.64685009 0.26959405 1.67626233 -11.11851079 6.89169181 29.03196631 Mo 2.85402479 1.74844657 1.49207130 11.65892456 -2.47474608 21.62411294