5
Lattice="4.37437 0.0 0.0 2.6785291093931036e-16 4.37437 0.0 2.6785291093931036e-16 2.6785291093931036e-16 4.37437" Properties=species:S:1:pos:R:3 energy=-28.996039535965984 magmom=0.0 pbc="T T T"
Ba       0.00398068       0.00000000       0.00000000
In       2.20520740       2.18718500       2.18718500
F        2.18617889       0.00000000       2.18718500
O        2.18749121       2.18718500       0.00000000
O        0.01688507       2.18718500       2.18718500