data_[Li2Ga2Ir4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Ga  1.8100  1.3000  0.7600
  Ir  2.2000  1.3500  0.7650
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.6025]
_cell_length_b [2.8030]
_cell_length_c [4.5055]
_cell_angle_alpha [90.0000]
_cell_angle_beta [113.5858]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [LiGaIr2]
_chemical_formula_sum '[Li2 Ga2 Ir4]'
_cell_volume [111.1379]
_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
[
  Li  Li0  2  0.1827  0.5000  0.2290  1.0
  Ga  Ga1  2  0.4146  0.5000  0.8139  1.0
  Ir  Ir2  2  0.1692  0.0000  0.7306  1.0
  Ir  Ir3  2  0.4355  0.0000  0.3208  1.0
]