data_[Mg2Ga16Rh4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Ga  1.8100  1.3000  0.7600
  Rh  2.2800  1.3500  0.7450
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.3983]
_cell_length_b [7.1240]
_cell_length_c [5.0556]
_cell_angle_alpha [90.0000]
_cell_angle_beta [99.9831]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Mg(Ga4Rh)2]
_chemical_formula_sum '[Mg2 Ga16 Rh4]'
_cell_volume [404.3072]
_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
[
  Mg  Mg0  2  0.0000  0.0000  0.0000  1.0
  Ga  Ga1  8  0.1061  0.2810  0.4103  1.0
  Ga  Ga2  4  0.0776  0.5000  0.8495  1.0
  Ga  Ga3  4  0.2142  0.0000  0.8091  1.0
  Rh  Rh4  4  0.2256  0.0000  0.3148  1.0
]