data_[Th12Co4Os4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Th  1.3000  1.8000  1.0800
  Co  1.8800  1.3500  0.7683
  Os  2.2000  1.3000  0.6730
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.8518]
_cell_length_b [3.9345]
_cell_length_c [8.3295]
_cell_angle_alpha [90.0000]
_cell_angle_beta [94.0501]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Th3CoOs]
_chemical_formula_sum '[Th12 Co4 Os4]'
_cell_volume [485.5086]
_cell_formula_units_Z [4]
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  0.0440  0.0000  0.3101  1
  Th  Th1  4  0.1074  0.5000  0.9547  1
  Th  Th2  4  0.2318  0.0000  0.6843  1
  Co  Co3  4  0.2070  0.0000  0.0813  1
  Os  Os4  4  0.1060  0.5000  0.5464  1
]