data_[K1Dy1Mg2Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Dy  1.2200  1.7500  1.1310
  Mg  1.3100  1.5000  0.8600
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.4631]
_cell_length_b [6.4720]
_cell_length_c [8.8451]
_cell_angle_alpha [79.9605]
_cell_angle_beta [79.7272]
_cell_angle_gamma [79.5968]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [KDyMg2Cl8]
_chemical_formula_sum '[K1 Dy1 Mg2 Cl8]'
_cell_volume [354.1859]
_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
[
  K  K0  1  0.0000  0.0000  0.5000  1.0
  Dy  Dy1  1  0.0000  0.0000  0.0000  1.0
  Mg  Mg2  2  0.4534  0.4563  0.7125  1.0
  Cl  Cl3  2  0.2093  0.7628  0.2204  1.0
  Cl  Cl4  2  0.2488  0.8012  0.7765  1.0
  Cl  Cl5  2  0.2639  0.2783  0.9537  1.0
  Cl  Cl6  2  0.3252  0.3371  0.5081  1.0
]