data_[Mg28Co2Sn2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mg  1.3100  1.5000  0.8600
  Co  1.8800  1.3500  0.7683
  Sn  1.9600  1.4500  0.8300
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [10.1262]
_cell_length_b [6.2804]
_cell_length_c [10.8624]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [Mg14CoSn]
_chemical_formula_sum '[Mg28 Co2 Sn2]'
_cell_volume [690.8118]
_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
[
  Mg  Mg0  8  0.2626  0.2413  0.9140  1.0
  Mg  Mg1  4  0.0000  0.2476  0.5829  1.0
  Mg  Mg2  4  0.2458  0.0000  0.1665  1.0
  Mg  Mg3  4  0.2604  0.0000  0.6724  1.0
  Mg  Mg4  4  0.5000  0.2488  0.0859  1.0
  Mg  Mg5  2  0.0000  0.0000  0.3347  1.0
  Mg  Mg6  2  0.0000  0.0000  0.8333  1.0
  Co  Co7  2  0.5000  0.0000  0.8311  1.0
  Sn  Sn8  2  0.5000  0.0000  0.3294  1.0
]