# generated using pymatgen
data_KPO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.62127600
_cell_length_b   5.24156400
_cell_length_c   7.35410083
_cell_angle_alpha   82.25810914
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KPO4
_chemical_formula_sum   'K2 P2 O8'
_cell_volume   214.70819674
_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
  K  K0  1  0.75000000  0.19781500  0.76366200  1.0
  K  K1  1  0.25000000  0.80218500  0.23633800  1.0
  P  P2  1  0.25000000  0.72465000  0.75931100  1.0
  P  P3  1  0.75000000  0.27535000  0.24068900  1.0
  O  O4  1  0.25000000  0.94229600  0.59324000  1.0
  O  O5  1  0.75000000  0.05770400  0.40676000  1.0
  O  O6  1  0.25000000  0.47890400  0.66482500  1.0
  O  O7  1  0.75000000  0.52109600  0.33517500  1.0
  O  O8  1  0.02795700  0.74917700  0.87831900  1.0
  O  O9  1  0.52795700  0.25082300  0.12168100  1.0
  O  O10  1  0.97204300  0.25082300  0.12168100  1.0
  O  O11  1  0.47204300  0.74917700  0.87831900  1.0