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=27.9495480718 stress="-17.784310446334928 -0.8044609827541565 -0.22453954713106056 -0.8044609827541565 -18.013866670404 -1.3160645002284967 -0.22453954713106056 -1.3160645002284967 -18.304613785216787" pbc="F F F" Cd 0.26959405 0.17626233 -0.14597521 -22.27148866 -30.25737169 -38.04544302 Cd 1.70996341 1.49207130 0.15300231 29.85881017 30.05348296 -17.15349325 Cd 1.53848316 -0.04225341 1.41852158 18.66855073 -25.20414743 27.11540073 Cd -0.04210664 1.38825682 1.27041603 -26.25587223 25.40803616 28.08353554