data_[Li6Mn2F10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Li  0.9800  1.4500  0.9000
  Mn  1.5500  1.4000  0.6483
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.1251]
_cell_length_b [5.6893]
_cell_length_c [7.8569]
_cell_angle_alpha [97.1390]
_cell_angle_beta [107.9638]
_cell_angle_gamma [112.0899]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Li3MnF5]
_chemical_formula_sum '[Li6 Mn2 F10]'
_cell_volume [194.2808]
_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
[
  Li  Li0  2  0.0580  0.4383  0.7015  1.0
  Li  Li1  2  0.3161  0.5437  0.0896  1.0
  Li  Li2  2  0.3320  0.9725  0.7010  1.0
  Mn  Mn3  1  0.0000  0.0000  0.0000  1.0
  Mn  Mn4  1  0.5000  0.5000  0.5000  1.0
  F  F5  2  0.0397  0.2866  0.4598  1.0
  F  F6  2  0.1224  0.7034  0.9279  1.0
  F  F7  2  0.2498  0.2523  0.8620  1.0
  F  F8  2  0.3704  0.7351  0.3295  1.0
  F  F9  2  0.4428  0.2505  0.2402  1.0
]