# generated using pymatgen
data_KPr(NiO3)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.46818515
_cell_length_b   5.46818515
_cell_length_c   7.75024238
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.23058562
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KPr(NiO3)4
_chemical_formula_sum   'K1 Pr1 Ni4 O12'
_cell_volume   231.73849894
_cell_formula_units_Z   1
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
  K  K0  1  0.99953802  0.99953802  0.00000000  1.0
  Pr  Pr1  1  0.50545217  0.50545217  0.50000000  1.0
  Ni  Ni2  1  0.49918240  0.00031303  0.75358440  1.0
  Ni  Ni3  1  0.49918240  0.00031303  0.24641560  1.0
  Ni  Ni4  1  0.00031303  0.49918240  0.24641560  1.0
  Ni  Ni5  1  0.00031303  0.49918240  0.75358440  1.0
  O  O6  1  0.73121185  0.26950405  0.73443073  1.0
  O  O7  1  0.26950405  0.73121185  0.73443073  1.0
  O  O8  1  0.26950405  0.73121185  0.26556927  1.0
  O  O9  1  0.73121185  0.26950405  0.26556927  1.0
  O  O10  1  0.73952861  0.73952861  0.74063771  1.0
  O  O11  1  0.26216535  0.26216535  0.72550059  1.0
  O  O12  1  0.26216535  0.26216535  0.27449941  1.0
  O  O13  1  0.73952861  0.73952861  0.25936229  1.0
  O  O14  1  0.49576796  0.00583663  0.00000000  1.0
  O  O15  1  0.50633724  0.98225741  0.50000000  1.0
  O  O16  1  0.00583663  0.49576796  0.00000000  1.0
  O  O17  1  0.98225741  0.50633724  0.50000000  1.0