data_[Mn4Be8F24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Be  1.5700  1.0500  0.5900
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.8478]
_cell_length_b [9.1456]
_cell_length_c [5.2276]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.8486]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [MnBe2F6]
_chemical_formula_sum '[Mn4 Be8 F24]'
_cell_volume [445.5694]
_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
[
  Mn  Mn0  4  0.0000  0.1209  0.7500  1.0
  Be  Be1  8  0.2013  0.4216  0.7294  1.0
  F  F2  8  0.1269  0.0660  0.1602  1.0
  F  F3  8  0.1483  0.4959  0.9526  1.0
  F  F4  8  0.1507  0.2621  0.6953  1.0
]