data_[Ho2Be2Pt6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ho  1.2300  1.7500  1.0410
  Be  1.5700  1.0500  0.5900
  Pt  2.2800  1.3500  0.8050
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [5.3634]
_cell_length_b [5.7242]
_cell_length_c [5.9204]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.3764]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [HoBePt3]
_chemical_formula_sum '[Ho2 Be2 Pt6]'
_cell_volume [164.2244]
_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  2  0.0211  0.2500  0.2966  1.0
  Be  Be1  2  0.3419  0.7500  0.4549  1.0
  Pt  Pt2  4  0.4812  0.5055  0.2272  1.0
  Pt  Pt3  2  0.0870  0.2500  0.8257  1.0
]