data_[Sr12Ga4Bi4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ga  1.8100  1.3000  0.7600
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.6380]
_cell_length_b [4.6259]
_cell_length_c [9.4005]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.7097]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sr3GaBi]
_chemical_formula_sum '[Sr12 Ga4 Bi4]'
_cell_volume [764.4105]
_cell_formula_units_Z [4]
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
[
  Sr  Sr0  4  0.0505  0.0000  0.1773  1.0
  Sr  Sr1  4  0.1082  0.5000  0.5637  1.0
  Sr  Sr2  4  0.2415  0.0000  0.8131  1.0
  Ga  Ga3  4  0.2123  0.0000  0.4372  1.0
  Bi  Bi4  4  0.1072  0.5000  0.9244  1.0
]