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=-1.81526234865 stress="-12.84779772886504 0.7282526025263768 -0.08497988935337451 0.7282526025263768 -10.693106195542716 0.5697773161012869 -0.08497988935337451 0.5697773161012869 -10.334176309365214" pbc="F F F" W 0.26959405 0.17626233 -0.14597521 -13.99398967 -13.91713298 -19.48142805 W 1.70996341 1.49207130 0.15300231 19.46081729 17.34590083 -11.95058378 W 1.53848316 -0.04225341 1.41852158 15.41214178 -18.42320316 17.31533273 W -0.04210664 1.38825682 1.27041603 -20.87896941 14.99443531 14.11667910