data_[Sr2Sb2As2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sr  0.9500  2.0000  1.3200
  Sb  2.0500  1.4500  0.8300
  As  2.1800  1.1500  0.6600
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [4.6299]
_cell_length_b [4.2085]
_cell_length_c [9.2353]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.7142]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [SrSbAs]
_chemical_formula_sum '[Sr2 Sb2 As2]'
_cell_volume [175.5366]
_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
[
  Sr  Sr0  2  0.0882  0.2500  0.1982  1.0
  Sb  Sb1  2  0.2941  0.7500  0.5172  1.0
  As  As2  2  0.4632  0.2500  0.9157  1.0
]