4 Lattice="4.64008250945916 -0.6851604005611175 3.015333726061407e-16 -1.288601925667342 3.970487362186942 3.0364493228986697e-16 1.9664995492589444e-15 -1.501549122001891e-16 20.074575808371993" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-9.328139202692565 stress="2.266291862132538e-05 -4.704846983350247e-06 7.007746157011198e-05 -4.704846983350247e-06 -6.013469497236941e-07 -1.2624714356216214e-05 7.007746157011198e-05 -1.2624714356216214e-05 -1.394911713106814e-05" dipole="3.749500129399631 7.717412404530687 -0.02601782384009685" magmom=0.0 free_energy=-9.33993315795674 pbc="T T F" Se 0.16577271 2.82071782 9.61187260 0.00000000 0.00152206 -0.00391967 -0.00741753 0.00000000 I 3.49877672 1.70829502 7.45904946 0.00000000 0.00433807 0.00294433 0.00161704 0.00000000 I 2.76985936 -0.72585394 12.61833323 0.00000000 -0.00412553 0.00651393 0.00179172 0.00000000 Ag 0.92255665 0.87148018 11.18922356 0.00000000 -0.00173963 -0.00553480 0.00405145 0.00000000