data_[Ca2Ag2Ru2F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ca  1.0000  1.8000  1.1400
  Ag  1.9300  1.6000  1.0867
  Ru  2.2000  1.3000  0.6610
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P4_2nm]
_cell_length_a [5.1983]
_cell_length_b [5.1983]
_cell_length_c [10.5159]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [102]
_chemical_formula_structural [CaAgRuF6]
_chemical_formula_sum '[Ca2 Ag2 Ru2 F12]'
_cell_volume [284.1677]
_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
[
  Ca  Ca0  2  0.0000  0.0000  0.6687  1.0
  Ag  Ag1  2  0.0000  0.0000  0.9978  1.0
  Ru  Ru2  2  0.0000  0.0000  0.3333  1.0
  F  F3  4  0.1758  0.8242  0.4846  1.0
  F  F4  4  0.1908  0.8092  0.1914  1.0
  F  F5  4  0.2264  0.7736  0.8241  1.0
]