data_[Ni1Ag1Br4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ni  1.9100  1.3500  0.7400
  Ag  1.9300  1.6000  1.0867
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [7.2407]
_cell_length_b [3.6780]
_cell_length_c [7.3796]
_cell_angle_alpha [90.0000]
_cell_angle_beta [117.7284]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [NiAgBr4]
_chemical_formula_sum '[Ni1 Ag1 Br4]'
_cell_volume [173.9605]
_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
[
  Ni  Ni0  1  0.5000  0.0000  0.5000  1.0
  Ag  Ag1  1  0.0000  0.5000  0.5000  1.0
  Br  Br2  2  0.2737  0.5000  0.2717  1.0
  Br  Br3  2  0.2899  0.0000  0.7116  1.0
]