data_[Er16Ga24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Er  1.2400  1.7500  1.0300
  Ga  1.8100  1.3000  0.7600
]
_symmetry_space_group_name_H-M [Fdd2]
_cell_length_a [10.0308]
_cell_length_b [14.5914]
_cell_length_c [5.7772]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [43]
_chemical_formula_structural [Er2Ga3]
_chemical_formula_sum '[Er16 Ga24]'
_cell_volume [845.5766]
_cell_formula_units_Z [8]
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
[
  Er  Er0  16  0.0773  0.3022  0.2586  1.0
  Ga  Ga1  16  0.0694  0.3810  0.7550  1.0
  Ga  Ga2  8  0.0000  0.0000  0.5942  1.0
]