data_[K2Ti2Ga2O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Ti  1.5400  1.4000  0.8517
  Ga  1.8100  1.3000  0.7600
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.4590]
_cell_length_b [5.5601]
_cell_length_c [6.8992]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.5111]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [KTiGaO4]
_chemical_formula_sum '[K2 Ti2 Ga2 O8]'
_cell_volume [204.4338]
_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  2  0.3540  0.2500  0.9067  1
  Ti  Ti1  2  0.3414  0.7500  0.5234  1
  Ga  Ga2  2  0.1001  0.2500  0.3397  1
  O  O3  4  0.3572  0.0198  0.3377  1
  O  O4  2  0.0074  0.2500  0.5848  1
  O  O5  2  0.2357  0.7500  0.7822  1
]