data_[Gd4Mo4O16F4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Gd  1.2000  1.8000  1.0750
  Mo  2.1600  1.4500  0.7750
  O  3.4400  0.6000  1.2600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [9.6073]
_cell_length_b [7.2644]
_cell_length_c [6.8465]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.4460]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [GdMoO4F]
_chemical_formula_sum '[Gd4 Mo4 O16 F4]'
_cell_volume [453.2748]
_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
[
  Gd  Gd0  4  0.2013  0.0000  0.0930  1
  Mo  Mo1  4  0.1496  0.5000  0.2808  1
  O  O2  8  0.2132  0.3103  0.1626  1
  O  O3  4  0.0435  0.5000  0.7892  1
  O  O4  4  0.2285  0.5000  0.5489  1
  F  F5  4  0.0049  0.0000  0.8149  1
]