4 Lattice="3.8951314093202756 1.2588104409279539e-16 0.0 1.0486081903089668e-16 3.8974623778984787 0.0 1.14231316179029e-16 0.0 17.827337479999997" Properties=species:S:1:pos:R:3:initial_magmoms:R:1 energy=-29.457831822471846 dipole="4.555326360635991e-08 -0.004038543250425681 2.3204372022583344e-06" free_energy=-29.468691471520412 pbc="T T F" Nb 0.00000000 0.00013760 8.91361692 0.00000000 Se -0.00000000 1.95102820 10.76814338 0.00000000 Nb 1.94756571 1.94817122 8.91377214 0.00000000 Se -0.00000000 1.94602017 7.05918998 0.00000000