data_[Na2Nd1Co1F8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Nd  1.1400  1.8500  1.2765
  Co  1.8800  1.3500  0.7683
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [4.4348]
_cell_length_b [7.0709]
_cell_length_c [5.4101]
_cell_angle_alpha [90.0000]
_cell_angle_beta [91.9058]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Na2NdCoF8]
_chemical_formula_sum '[Na2 Nd1 Co1 F8]'
_cell_volume [169.5542]
_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
[
  Na  Na0  2  0.5000  0.2345  0.5000  1
  Nd  Nd1  1  0.0000  0.5000  0.0000  1
  Co  Co2  1  0.0000  0.0000  0.0000  1
  F  F3  4  0.1320  0.2201  0.7906  1
  F  F4  2  0.3309  0.0000  0.2128  1
  F  F5  2  0.4242  0.5000  0.2488  1
]