data_[La10Ga10Ir4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  La  1.1000  1.9500  1.1720
  Ga  1.8100  1.3000  0.7600
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [15.5724]
_cell_length_b [4.5162]
_cell_length_c [11.6024]
_cell_angle_alpha [90.0000]
_cell_angle_beta [131.7826]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [La5Ga5Ir2]
_chemical_formula_sum '[La10 Ga10 Ir4]'
_cell_volume [608.4502]
_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
[
  La  La0  4  0.1185  0.5000  0.9231  1
  La  La1  4  0.1965  0.5000  0.3259  1
  La  La2  2  0.0000  0.5000  0.5000  1
  Ga  Ga3  4  0.0492  0.0000  0.3363  1
  Ga  Ga4  4  0.2395  0.0000  0.1852  1
  Ga  Ga5  2  0.0000  0.0000  0.0000  1
  Ir  Ir6  4  0.1582  0.0000  0.7649  1
]