# generated using pymatgen
data_KAlFe2F2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.46675000
_cell_length_b   6.46675000
_cell_length_c   6.64972400
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   KAlFe2F2
_chemical_formula_sum   'K2 Al2 Fe4 F4'
_cell_volume   278.08384749
_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  0.00000000  0.50000000  0.50000000  1.0
  K  K1  1  0.50000000  0.00000000  0.50000000  1.0
  Al  Al2  1  0.00000000  0.00000000  0.00000000  1.0
  Al  Al3  1  0.50000000  0.50000000  0.00000000  1.0
  Fe  Fe4  1  0.14704100  0.64704100  0.00000000  1.0
  Fe  Fe5  1  0.85295900  0.35295900  0.00000000  1.0
  Fe  Fe6  1  0.35295900  0.14704100  0.00000000  1.0
  Fe  Fe7  1  0.64704100  0.85295900  0.00000000  1.0
  F  F8  1  0.00000000  0.00000000  0.27788200  1.0
  F  F9  1  0.00000000  0.00000000  0.72211800  1.0
  F  F10  1  0.50000000  0.50000000  0.72211800  1.0
  F  F11  1  0.50000000  0.50000000  0.27788200  1.0