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=-5.380131445702634 stress="-0.1455094333608758 -0.05857426943176133 0.08822267135555283 -0.05857426943176133 -0.03620358702407025 0.05868720472527447 0.08822267135555283 0.05868720472527447 -0.010457337706420548" free_energy=-5.380131445702634 pbc="F T T" H 0.06013337 0.16039283 0.39645456 -1.05387345 -0.13052354 0.99240085 Zn 1.70352043 1.54765730 0.26267270 4.12916863 1.35728096 -1.64521871 O 1.62136930 0.17504889 1.61860870 -1.87447947 -0.44468369 0.22202258 H 0.00230811 1.45779895 1.55941220 -1.20081571 -0.78207373 0.43079528