20 Lattice="4.033696781662676 4.033696781662676 0.0 -4.033696781662676 4.033696781662676 0.0 0.0 0.0 8.067393563325352" Properties=species:S:1:pos:R:3:initial_magmoms:R:1 energy=-140.16645500974116 pbc="T T T" Ba 0.00110037 0.00166684 -0.00000292 0.00000000 Ti 2.01687413 2.01746737 2.01757864 0.00000000 O 2.01743772 2.01864801 0.01154945 0.00000000 O 0.01074164 2.01742461 2.01729248 0.00000000 O -2.01712515 4.04487228 2.01675788 0.00000000 Na -0.00053613 4.03304102 0.00115437 0.00000000 Sb 2.01683534 6.05057601 2.01694329 0.00000000 O 2.01569782 6.05101120 -0.01192550 0.00000000 O -0.01085902 6.05065485 2.01700670 0.00000000 O 2.01713116 4.02318355 2.01675418 0.00000000 Na 0.00052154 -0.00066251 4.03487313 0.00000000 Sb 2.01581541 2.02026115 6.05044419 0.00000000 O 2.01577470 2.01859480 4.02125591 0.00000000 O -0.01143983 2.01697928 6.05033870 0.00000000 O -2.00930042 4.02509448 6.05271982 0.00000000 Ba -0.00116797 4.03539829 4.03373024 0.00000000 Ti 2.01675922 6.05495919 6.05001412 0.00000000 O 2.01758010 6.05099811 4.04596369 0.00000000 O 0.01242604 6.06442682 6.04312970 0.00000000 O 2.00807162 4.04952685 6.05271213 0.00000000