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=67.54429472026334 stress="-4.2738048782449125 -0.06791347997035331 -0.3605915665833116 -0.06791347997035331 -7.8848296707913095 1.0063934535197152 -0.3605915665833116 1.0063934535197152 -6.885378475030777" free_energy=67.54429472026334 pbc="F T T" Cd 0.17621204 0.13215382 2.71035018 -37.23694496 -23.96979042 3.54335764 Cd 1.53922890 1.37689326 0.24956261 35.93074813 35.66482743 -26.62671882 Se 1.77680686 0.09967038 1.23585413 38.82482515 -28.06024294 28.38008235 Te 0.06224969 1.34915582 1.48058377 -37.51862832 16.36520594 -5.29672116