data_[Sb4As2P2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sb  2.0500  1.4500  0.8300
  As  2.1800  1.1500  0.6600
  P  2.1900  1.0000  0.5500
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [11.8011]
_cell_length_b [4.0012]
_cell_length_c [4.5532]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.3812]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [Sb2AsP]
_chemical_formula_sum '[Sb4 As2 P2]'
_cell_volume [214.9934]
_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
[
  Sb  Sb0  2  0.2561  0.0000  0.5545  1.0
  Sb  Sb1  2  0.4890  0.5000  0.0827  1.0
  As  As2  2  0.4810  0.0000  0.6817  1.0
  P  P3  2  0.2738  0.5000  0.1811  1.0
]