data_[Ga8Mo4F44]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ga  1.8100  1.3000  0.7600
  Mo  2.1600  1.4500  0.7750
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [Ibam]
_cell_length_a [5.9801]
_cell_length_b [11.0712]
_cell_length_c [12.6163]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [72]
_chemical_formula_structural [Ga2MoF11]
_chemical_formula_sum '[Ga8 Mo4 F44]'
_cell_volume [835.2948]
_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
[
  Ga  Ga0  8  0.1797  0.1414  0.5000  1
  Mo  Mo1  4  0.0000  0.5000  0.2500  1
  F  F2  16  0.1661  0.3851  0.3255  1
  F  F3  16  0.2407  0.3962  0.1342  1
  F  F4  8  0.0617  0.2451  0.0000  1
  F  F5  4  0.0000  0.0000  0.0000  1
]