data_[Sr10Th2Pt8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Th  1.3000  1.8000  1.0800
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.8041]
_cell_length_b [4.3280]
_cell_length_c [8.5519]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.2120]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sr5ThPt4]
_chemical_formula_sum '[Sr10 Th2 Pt8]'
_cell_volume [674.6940]
_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
[
  Sr  Sr0  4  0.1623  0.0000  0.3285  1
  Sr  Sr1  4  0.1694  0.0000  0.8456  1
  Sr  Sr2  2  0.0000  0.5000  0.5000  1
  Th  Th3  2  0.0000  0.5000  0.0000  1
  Pt  Pt4  4  0.0024  0.0000  0.7685  1
  Pt  Pt5  4  0.1584  0.5000  0.0867  1
]