data_[Zr4Be8Co4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zr  1.3300  1.5500  0.8600
  Be  1.5700  1.0500  0.5900
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [5.9071]
_cell_length_b [3.6933]
_cell_length_c [9.1733]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [ZrBe2Co]
_chemical_formula_sum '[Zr4 Be8 Co4]'
_cell_volume [200.1307]
_cell_formula_units_Z [4]
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
[
  Zr  Zr0  4  0.2003  0.7500  0.1373  1.0
  Be  Be1  4  0.1308  0.7500  0.8255  1.0
  Be  Be2  4  0.2236  0.7500  0.4256  1.0
  Co  Co3  4  0.0221  0.2500  0.3956  1.0
]