data_[Sr1Ga1Cu2F8]
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 [P-1]
_cell_length_a [4.7950]
_cell_length_b [5.0891]
_cell_length_c [7.1039]
_cell_angle_alpha [81.7581]
_cell_angle_beta [85.9563]
_cell_angle_gamma [86.1808]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [SrGaCu2F8]
_chemical_formula_sum '[Sr1 Ga1 Cu2 F8]'
_cell_volume [170.8512]
_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
[
  Sr  Sr0  1  0.0000  0.0000  0.5000  1.0
  Ga  Ga1  1  0.0000  0.0000  0.0000  1.0
  Cu  Cu2  2  0.4736  0.4805  0.7623  1.0
  F  F3  2  0.1715  0.7855  0.2162  1.0
  F  F4  2  0.1812  0.7961  0.8100  1.0
  F  F5  2  0.2943  0.2429  0.9717  1.0
  F  F6  2  0.3773  0.2913  0.4596  1.0
]