data_[Sr4Ga4F20]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.3335]
_cell_length_b [6.7418]
_cell_length_c [7.9225]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.6016]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [SrGaF5]
_chemical_formula_sum '[Sr4 Ga4 F20]'
_cell_volume [453.2686]
_cell_formula_units_Z [4]
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  4  0.0000  0.4541  0.2500  1.0
  Ga  Ga1  4  0.0000  0.0000  0.0000  1.0
  F  F2  8  0.0122  0.2834  0.9734  1.0
  F  F3  8  0.2183  0.0187  0.6096  1.0
  F  F4  4  0.0000  0.0647  0.2500  1.0
]