data_[Ba4Ga4As4P2]
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
  As  2.1800  1.1500  0.6600
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.2467]
_cell_length_b [4.6559]
_cell_length_c [7.8355]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.5583]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ba2Ga2As2P]
_chemical_formula_sum '[Ba4 Ga4 As4 P2]'
_cell_volume [393.1422]
_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
[
  Ba  Ba0  4  0.0563  0.5000  0.3160  1.0
  Ga  Ga1  4  0.2060  0.0000  0.0843  1.0
  As  As2  4  0.1912  0.0000  0.7381  1.0
  P  P3  2  0.0000  0.0000  0.0000  1.0
]