3 Lattice="3.481358080237393 2.1449987209003835e-19 0.0 -1.7406790401186965 3.014944537155806 0.0 -3.75244566795038e-18 0.0 18.366460053367316" Properties=species:S:1:pos:R:3 energy=-19.828300289180394 dipole="-2.126323212616335e-08 1.2276328042949359e-08 -2.3969323552057034e-09" free_energy=-19.837590911019564 pbc="T T F" Nb -0.00000000 0.00000000 9.18323009 Se 1.74067904 1.00498151 10.85218622 Se -0.00000000 2.00996302 7.51427384