data_[Ba4Ga4P8H4]
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
  P  2.1900  1.0000  0.5500
  H  2.2000  0.2500  0.0000
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [12.7341]
_cell_length_b [3.7502]
_cell_length_c [9.2435]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.5197]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [BaGaP2H]
_chemical_formula_sum '[Ba4 Ga4 P8 H4]'
_cell_volume [429.2001]
_cell_formula_units_Z [4]
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  0.1695  0.5000  0.6911  1
  Ga  Ga1  4  0.0566  0.0000  0.1771  1
  P  P2  4  0.1149  0.5000  0.3304  1
  P  P3  4  0.1308  0.0000  0.9548  1
  H  H4  4  0.1275  0.5000  0.9550  1
]