data_[Ba2Mg28Co2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Mg  1.3100  1.5000  0.8600
  Co  1.8800  1.3500  0.7683
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [10.5378]
_cell_length_b [6.2216]
_cell_length_c [11.6813]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [BaMg14Co]
_chemical_formula_sum '[Ba2 Mg28 Co2]'
_cell_volume [765.8524]
_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
[
  Ba  Ba0  2  0.5000  0.0000  0.6977  1
  Mg  Mg1  8  0.2463  0.2437  0.0751  1
  Mg  Mg2  4  0.0000  0.2431  0.4201  1
  Mg  Mg3  4  0.2250  0.0000  0.8351  1
  Mg  Mg4  4  0.2974  0.0000  0.3078  1
  Mg  Mg5  4  0.5000  0.2408  0.9506  1
  Mg  Mg6  2  0.0000  0.0000  0.1713  1
  Mg  Mg7  2  0.0000  0.0000  0.6634  1
  Co  Co8  2  0.5000  0.0000  0.1401  1
]