4 Lattice="3.9673903193633184 2.95000269667161e-18 0.0 3.2063344178225845e-17 3.9682217355078455 0.0 2.793315254817394e-17 0.0 17.5485859" Properties=species:S:1:pos:R:3:initial_magmoms:R:1 energy=-20.340901099673275 dipole="3.569931445078786e-08 0.012872580853866698 -2.3670176651810793e-05" free_energy=-20.35370655103319 pbc="T T F" Pt 0.00000000 -0.00056680 8.77437270 0.00000000 Se -0.00000000 1.98497375 10.38316910 0.00000000 Pt 1.98369516 1.98199500 8.77399862 0.00000000 Se 0.00000000 1.98508770 7.16550975 0.00000000