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=27.9495440479 stress="-17.784285426927816 -0.8044746576707776 -0.22452080425224102 -0.8044746576707776 -18.01394836930669 -1.316128904942962 -0.22452080425224102 -1.316128904942962 -18.30467362644477" pbc="F F F" Cd 0.26959405 0.17626233 -0.14597521 -22.27144325 -30.25763494 -38.04563404 Cd 1.70996341 1.49207130 0.15300231 29.85881281 30.05357252 -17.15348015 Cd 1.53848316 -0.04225341 1.41852158 18.66847219 -25.20415836 27.11537396 Cd -0.04210664 1.38825682 1.27041603 -26.25584176 25.40822078 28.08374024