20
Lattice="4.247037313886318 4.247037313886318 0.0 -4.247037313886318 4.247037313886318 0.0 0.0 0.0 8.494074627772637" Properties=species:S:1:pos:R:3:initial_magmoms:R:1 energy=-161.95059412379334 pbc="T T T"
Ba       0.00005284      -0.00031423      -0.00109065       0.00000000
Zr       2.12353259       2.12348976       2.12372219       0.00000000
O        2.12355003       2.12343505      -0.00772533       0.00000000
O       -0.00439826       2.12526450       2.12303572       0.00000000
O       -2.12275372       4.24266006       2.12311796       0.00000000
Pb      -0.00006207       4.24444185       0.00342880       0.00000000
Hf       2.12350582       6.37053592       2.12369459       0.00000000
O        2.12349344       6.37045127       0.00738997       0.00000000
O        0.00439551       6.37007926       2.12354930       0.00000000
O        2.12275406       4.25145129       2.12311831       0.00000000
Pb       0.00006044      -0.00256108       4.25055663       0.00000000
Hf       2.12360066       2.12535484       6.37063655       0.00000000
O        2.12360766       2.12344209       4.25447991       0.00000000
O        0.00441415       2.12565072       6.37050037       0.00000000
O       -2.11418480       4.25771386       6.37085845       0.00000000
Ba      -0.00005264       4.24648431       4.24578241       0.00000000
Zr       2.12349979       6.37212009       6.37072797       0.00000000
O        2.12342707       6.37045875       4.23938431       0.00000000
O       -0.00514646       6.39614487       6.36698899       0.00000000
O        2.11439174       4.24859542       6.37086199       0.00000000