data_[Tl4Cr2Ga2O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Tl  1.6200  1.9000  1.3325
  Cr  1.6600  1.4000  0.9400
  Ga  1.8100  1.3000  0.7600
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.5417]
_cell_length_b [5.5365]
_cell_length_c [5.3586]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.7958]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Tl2CrGaO6]
_chemical_formula_sum '[Tl4 Cr2 Ga2 O12]'
_cell_volume [235.2476]
_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
[
  Tl  Tl0  4  0.2497  0.5000  0.2265  1.0
  Cr  Cr1  2  0.0000  0.5000  0.5000  1.0
  Ga  Ga2  2  0.0000  0.0000  0.0000  1.0
  O  O3  8  0.0677  0.2479  0.8179  1.0
  O  O4  4  0.2477  0.5000  0.6240  1.0
]