data_[Sr4Li4Ga4As8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Li  0.9800  1.4500  0.9000
  Ga  1.8100  1.3000  0.7600
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.5011]
_cell_length_b [4.2042]
_cell_length_c [10.1025]
_cell_angle_alpha [90.0000]
_cell_angle_beta [124.6955]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [SrLiGaAs2]
_chemical_formula_sum '[Sr4 Li4 Ga4 As8]'
_cell_volume [471.4728]
_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
[
  Sr  Sr0  4  0.1953  0.0000  0.6465  1.0
  Li  Li1  4  0.1443  0.5000  0.9247  1.0
  Ga  Ga2  4  0.0377  0.0000  0.1879  1.0
  As  As3  4  0.0615  0.5000  0.3544  1.0
  As  As4  4  0.1666  0.0000  0.0817  1.0
]