data_[Ba4Ga1Ag1I2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Ga  1.8100  1.3000  0.7600
  Ag  1.9300  1.6000  1.0867
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [P2/m]
_cell_length_a [8.4452]
_cell_length_b [4.8091]
_cell_length_c [9.2534]
_cell_angle_alpha [90.0000]
_cell_angle_beta [107.1139]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [10]
_chemical_formula_structural [Ba4GaAgI2]
_chemical_formula_sum '[Ba4 Ga1 Ag1 I2]'
_cell_volume [359.1684]
_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
[
  Ba  Ba0  2  0.2503  0.5000  0.2145  1.0
  Ba  Ba1  2  0.2628  0.0000  0.7822  1.0
  Ga  Ga2  1  0.5000  0.5000  0.0000  1.0
  Ag  Ag3  1  0.0000  0.0000  0.0000  1.0
  I  I4  1  0.0000  0.5000  0.5000  1.0
  I  I5  1  0.5000  0.0000  0.5000  1.0
]