data_[Ho6Er2Th4P12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Er  1.2400  1.7500  1.0300
  Th  1.3000  1.8000  1.0800
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [17.5998]
_cell_length_b [4.0498]
_cell_length_c [8.0651]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.1408]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ho3Er(ThP3)2]
_chemical_formula_sum '[Ho6 Er2 Th4 P12]'
_cell_volume [559.7878]
_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
[
  Ho  Ho0  4  0.1661  0.0000  0.8342  1
  Ho  Ho1  2  0.0000  0.5000  0.5000  1
  Er  Er2  2  0.0000  0.5000  0.0000  1
  Th  Th3  4  0.1646  0.0000  0.3297  1
  P  P4  4  0.0022  0.0000  0.7521  1
  P  P5  4  0.1650  0.5000  0.5878  1
  P  P6  4  0.1660  0.5000  0.0766  1
]