data_[Mn2Ga4F12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Ga  1.8100  1.3000  0.7600
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.0805]
_cell_length_b [5.7830]
_cell_length_c [4.7809]
_cell_angle_alpha [90.0000]
_cell_angle_beta [95.7339]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [MnGa2F6]
_chemical_formula_sum '[Mn2 Ga4 F12]'
_cell_volume [304.8232]
_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
[
  Mn  Mn0  2  0.0000  0.0000  0.0000  1
  Ga  Ga1  4  0.1921  0.5000  0.8990  1
  F  F2  8  0.0846  0.2619  0.7761  1
  F  F3  4  0.1678  0.0000  0.2921  1
]