data_[Sm4Y6Ho12Th2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sm  1.1700  1.8500  1.2290
  Y  1.2200  1.8000  1.0400
  Ho  1.2300  1.7500  1.0410
  Th  1.3000  1.8000  1.0800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [6.1757]
_cell_length_b [10.6857]
_cell_length_c [11.7817]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.0518]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Sm2Y3Ho6Th]
_chemical_formula_sum '[Sm4 Y6 Ho12 Th2]'
_cell_volume [765.5637]
_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
[
  Sm  Sm0  4  0.0000  0.3334  0.0000  1
  Y  Y1  4  0.0000  0.1672  0.5000  1
  Y  Y2  2  0.0000  0.5000  0.5000  1
  Ho  Ho3  8  0.2491  0.1649  0.2495  1
  Ho  Ho4  4  0.2453  0.0000  0.7504  1
  Th  Th5  2  0.0000  0.0000  0.0000  1
]