# generated using pymatgen
data_K3Nb8(O5F2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.19611800
_cell_length_b   4.19611800
_cell_length_c   21.95770500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K3Nb8(O5F2)2
_chemical_formula_sum   'K3 Nb8 O10 F4'
_cell_volume   386.61823269
_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  0.50000000  0.50000000  0.68638300  1.0
  K  K1  1  0.50000000  0.50000000  0.30410900  1.0
  K  K2  1  0.00000000  0.00000000  0.81402000  1.0
  Nb  Nb3  1  0.00000000  0.00000000  0.59275500  1.0
  Nb  Nb4  1  0.00000000  0.00000000  0.40608100  1.0
  Nb  Nb5  1  0.00000000  0.50000000  0.00048900  1.0
  Nb  Nb6  1  0.50000000  0.00000000  0.00048900  1.0
  Nb  Nb7  1  0.50000000  0.50000000  0.90798100  1.0
  Nb  Nb8  1  0.50000000  0.50000000  0.09997900  1.0
  Nb  Nb9  1  0.00000000  0.50000000  0.50004700  1.0
  Nb  Nb10  1  0.50000000  0.00000000  0.50004700  1.0
  O  O11  1  0.00000000  0.50000000  0.59746300  1.0
  O  O12  1  0.50000000  0.00000000  0.59746300  1.0
  O  O13  1  0.00000000  0.50000000  0.40343200  1.0
  O  O14  1  0.50000000  0.00000000  0.40343200  1.0
  O  O15  1  0.50000000  0.50000000  0.50031100  1.0
  O  O16  1  0.50000000  0.00000000  0.90271100  1.0
  O  O17  1  0.00000000  0.50000000  0.90271100  1.0
  O  O18  1  0.50000000  0.00000000  0.09539200  1.0
  O  O19  1  0.00000000  0.50000000  0.09539200  1.0
  O  O20  1  0.00000000  0.00000000  0.00029000  1.0
  F  F21  1  0.00000000  0.00000000  0.69428900  1.0
  F  F22  1  0.00000000  0.00000000  0.31034000  1.0
  F  F23  1  0.50000000  0.50000000  0.80645100  1.0
  F  F24  1  0.50000000  0.50000000  0.19114300  1.0