data_[Ga2Bi2]
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
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [3.2831]
_cell_length_b [3.3008]
_cell_length_c [10.4289]
_cell_angle_alpha [96.2657]
_cell_angle_beta [98.7233]
_cell_angle_gamma [90.6265]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [GaBi]
_chemical_formula_sum '[Ga2 Bi2]'
_cell_volume [110.9995]
_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
[
  Ga  Ga0  2  0.2923  0.7790  0.0786  1.0
  Bi  Bi1  2  0.4206  0.3764  0.3365  1.0
]