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=113.06124712630745 stress="-9.346573709672567 -0.6148163273737167 -0.40644043458532064 -0.6148163273737167 -10.58494235302244 0.16442270784850263 -0.40644043458532064 0.16442270784850263 -10.711173849796856" free_energy=113.06124712630745 pbc="T T T" Te 0.29920461 0.17918122 0.05957798 -0.69332779 -10.97877284 -9.37336201 Cd 1.66192607 1.49509235 0.03099333 -20.31909536 24.01875997 -24.69693190 Cd 1.69045800 0.27207381 1.42588762 -21.20449323 -31.21743146 17.34640368 Se 2.71223271 1.67379638 1.40411058 42.21691637 18.17744433 16.72389023