data_[K2Pa2Co2N6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Pa  1.5000  1.8000  1.0400
  Co  1.8800  1.3500  0.7683
  N  3.0400  0.6500  0.6300
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.7670]
_cell_length_b [3.5312]
_cell_length_c [8.1001]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.4734]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [KPaCoN3]
_chemical_formula_sum '[K2 Pa2 Co2 N6]'
_cell_volume [215.1073]
_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
[
  K  K0  2  0.1788  0.7500  0.2044  1
  Pa  Pa1  2  0.3437  0.2500  0.8377  1
  Co  Co2  2  0.0675  0.7500  0.5955  1
  N  N3  2  0.1472  0.2500  0.5585  1
  N  N4  2  0.1581  0.7500  0.8335  1
  N  N5  2  0.4654  0.2500  0.1262  1
]