data_image0
_chemical_formula_structural       KAlF4
_chemical_formula_sum              "K1 Al1 F4"
_cell_length_a       3.478151
_cell_length_b       3.478151
_cell_length_c       5.794657
_cell_angle_alpha    90.0
_cell_angle_beta     90.0
_cell_angle_gamma    90.0

_space_group_name_H-M_alt    "P 1"
_space_group_IT_number       1

loop_
  _space_group_symop_operation_xyz
  '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   K1        1.0  0.500001293790868  0.500001293790868  0.500000258859153  1.0000
  Al  Al1       1.0  0.0  0.500001293790868  0.500000258859153  1.0000
  F   F1        1.0  0.500001293790868  0.0  0.500000258859153  1.0000
  F   F2        1.0  0.500001293790868  0.500001293790868  0.19886768103789404  1.0000
  F   F3        1.0  0.500001293790868  0.500001293790868  0.801131110952728  1.0000
  F   F4        1.0  0.0  0.0  0.0  1.0000