data_[Li2Mn1Ag1Br6]
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
  Ag  1.9300  1.6000  1.0867
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [6.7063]
_cell_length_b [6.8180]
_cell_length_c [7.2253]
_cell_angle_alpha [65.6168]
_cell_angle_beta [64.3561]
_cell_angle_gamma [62.4108]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [Li2MnAgBr6]
_chemical_formula_sum '[Li2 Mn1 Ag1 Br6]'
_cell_volume [254.4627]
_cell_formula_units_Z [1]
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  1  0.0018  0.0050  0.0139  1
  Li  Li1  1  0.4811  0.4657  0.5472  1
  Mn  Mn2  1  0.6754  0.6687  0.9873  1
  Ag  Ag3  1  0.1914  0.1771  0.4553  1
  Br  Br4  1  0.0411  0.7610  0.7634  1
  Br  Br5  1  0.2949  0.6017  0.2220  1
  Br  Br6  1  0.4010  0.0750  0.7475  1
  Br  Br7  1  0.6105  0.8821  0.2294  1
  Br  Br8  1  0.7524  0.4318  0.7622  1
  Br  Br9  1  0.8888  0.2703  0.2566  1
]