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=47.5146427958 stress="-34.94966321567403 9.919077330320922 1.0651854845709154 9.919077330320922 -29.921402207489088 1.6902282489526599 1.0651854845709154 1.6902282489526599 -26.645844543477704" pbc="F F F" Cd 0.23171545 0.18190327 -0.17816502 -24.59098445 -22.28375911 -30.37310449 Cd 1.71219253 1.42485375 0.12990665 32.03212234 31.48673264 -26.87832526 Cd 1.28220450 0.28278197 1.56210000 62.59422953 -71.03460874 36.34901495 Cd 0.13362859 1.32702941 1.57034430 -70.03536742 61.83163520 20.90241480