data_[Pr6Ho2Tm12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pr  1.1300  1.8500  1.0600
  Ho  1.2300  1.7500  1.0410
  Tm  1.2500  1.7500  1.0950
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [13.2630]
_cell_length_b [3.5186]
_cell_length_c [14.6835]
_cell_angle_alpha [90.0000]
_cell_angle_beta [109.3121]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Pr3HoTm6]
_chemical_formula_sum '[Pr6 Ho2 Tm12]'
_cell_volume [646.6769]
_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
[
  Pr  Pr0  2  0.0348  0.7500  0.9043  1.0
  Pr  Pr1  2  0.1177  0.7500  0.4966  1.0
  Pr  Pr2  2  0.4907  0.7500  0.1094  1.0
  Ho  Ho3  2  0.4225  0.7500  0.3033  1.0
  Tm  Tm4  2  0.1111  0.2500  0.7117  1.0
  Tm  Tm5  2  0.1696  0.7500  0.2813  1.0
  Tm  Tm6  2  0.2461  0.2500  0.1024  1.0
  Tm  Tm7  2  0.2838  0.7500  0.8982  1.0
  Tm  Tm8  2  0.3430  0.7500  0.6871  1.0
  Tm  Tm9  2  0.3625  0.2500  0.4826  1.0
]