# generated using pymatgen
data_BaPrO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.40989202
_cell_length_b   6.40989192
_cell_length_c   6.40989202
_cell_angle_alpha   60.85499792
_cell_angle_beta   60.85500082
_cell_angle_gamma   60.85499792
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaPrO3
_chemical_formula_sum   'Ba2 Pr2 O6'
_cell_volume   189.81459274
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ba  Ba0  1  0.75000000  0.75000000  0.75000000  1.0
  Ba  Ba1  1  0.25000000  0.25000000  0.25000000  1.0
  Pr  Pr2  1  0.50000000  0.50000000  0.50000000  1.0
  Pr  Pr3  1  0.00000000  0.00000000  0.00000000  1.0
  O  O4  1  0.75000000  0.33691200  0.16308800  1.0
  O  O5  1  0.16308800  0.75000000  0.33691200  1.0
  O  O6  1  0.33691200  0.16308800  0.75000000  1.0
  O  O7  1  0.25000000  0.66308800  0.83691200  1.0
  O  O8  1  0.66308800  0.83691200  0.25000000  1.0
  O  O9  1  0.83691200  0.25000000  0.66308800  1.0