data_[Ga1Bi1Te1O6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  Bi  2.0200  1.6000  1.0350
  Te  2.1000  1.4000  1.2933
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [P312]
_cell_length_a [5.1759]
_cell_length_b [5.1759]
_cell_length_c [4.9499]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [149]
_chemical_formula_structural [GaBiTeO6]
_chemical_formula_sum '[Ga1 Bi1 Te1 O6]'
_cell_volume [114.8395]
_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
[
  Ga  Ga0  1  0.3333  0.6667  0.5000  1
  Bi  Bi1  1  0.0000  0.0000  0.0000  1
  Te  Te2  1  0.6667  0.3333  0.5000  1
  O  O3  6  0.3736  0.0061  0.2805  1
]