data_[Ac2Pr5Ho12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ac  1.1000  1.9500  1.2600
  Pr  1.1300  1.8500  1.0600
  Ho  1.2300  1.7500  1.0410
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.9152]
_cell_length_b [6.9444]
_cell_length_c [15.1607]
_cell_angle_alpha [80.0429]
_cell_angle_beta [87.5362]
_cell_angle_gamma [64.4992]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Ac2Pr5Ho12]
_chemical_formula_sum '[Ac2 Pr5 Ho12]'
_cell_volume [646.8199]
_cell_formula_units_Z [1]
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
[
  Ac  Ac0  2  0.0133  0.7332  0.0376  1
  Pr  Pr1  2  0.4459  0.4229  0.6147  1
  Pr  Pr2  2  0.4950  0.2335  0.0363  1
  Pr  Pr3  1  0.5000  0.0000  0.5000  1
  Ho  Ho4  2  0.0150  0.1193  0.3872  1
  Ho  Ho5  2  0.0667  0.6153  0.4205  1
  Ho  Ho6  2  0.2391  0.5703  0.8207  1
  Ho  Ho7  2  0.2475  0.0822  0.7520  1
  Ho  Ho8  2  0.2593  0.9201  0.1926  1
  Ho  Ho9  2  0.2798  0.3766  0.2493  1
]