data_[Th6Ga8Pt4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  Ga  1.8100  1.3000  0.7600
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.0011]
_cell_length_b [4.4851]
_cell_length_c [8.5373]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.9397]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Th3(Ga2Pt)2]
_chemical_formula_sum '[Th6 Ga8 Pt4]'
_cell_volume [395.9877]
_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
[
  Th  Th0  4  0.1777  0.5000  0.6496  1
  Th  Th1  2  0.0000  0.0000  0.0000  1
  Ga  Ga2  4  0.0235  0.0000  0.3634  1
  Ga  Ga3  4  0.2330  0.5000  0.0702  1
  Pt  Pt4  4  0.1026  0.5000  0.2766  1
]