data_[Sr12In12Ga4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.2891]
_cell_length_b [4.6953]
_cell_length_c [16.7112]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.1682]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sr3In3Ga]
_chemical_formula_sum '[Sr12 In12 Ga4]'
_cell_volume [910.7916]
_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  0.0242  0.5000  0.3854  1
  Sr  Sr1  4  0.1080  0.5000  0.9213  1
  Sr  Sr2  4  0.2437  0.5000  0.2348  1
  In  In3  4  0.0308  0.0000  0.2353  1
  In  In4  4  0.1096  0.0000  0.0777  1
  In  In5  4  0.1527  0.0000  0.5364  1
  Ga  Ga6  4  0.2301  0.0000  0.3860  1
]