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=4.241608589063675 stress="-2.1974499955170934 0.2616246589068287 0.07069609673379491 0.2616246589068287 -2.2986174572067997 0.020158614666720455 0.07069609673379491 0.020158614666720455 -2.274966044625776" free_energy=4.241608589063675 pbc="F T T" V 0.16980798 2.96427615 0.02184289 -16.83916427 -8.38805907 -6.74037457 V 1.65019543 1.63350600 0.14618898 18.12822761 3.21324891 -7.98422201 V 1.73454065 0.17889202 1.53310309 21.79589969 -8.14845084 5.94242406 V 0.23956773 1.22557373 1.40977949 -23.08496303 13.32326101 8.78217252