data_[Sr2Ga2Cu2F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Ga  1.8100  1.3000  0.7600
  Cu  1.9000  1.3500  0.8200
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [5.4485]
_cell_length_b [9.7641]
_cell_length_c [5.1022]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.5757]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [SrGaCuF6]
_chemical_formula_sum '[Sr2 Ga2 Cu2 F12]'
_cell_volume [271.1583]
_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
[
  Sr  Sr0  2  0.0000  0.0085  0.0000  1.0
  Ga  Ga1  2  0.0000  0.3367  0.5000  1.0
  Cu  Cu2  2  0.0000  0.6731  0.5000  1.0
  F  F3  4  0.1663  0.4717  0.3008  1.0
  F  F4  4  0.1664  0.1884  0.3109  1.0
  F  F5  4  0.2339  0.8308  0.2450  1.0
]