data_[Sb2As4Cl2]
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
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.9400]
_cell_length_b [3.4458]
_cell_length_c [4.9394]
_cell_angle_alpha [90.0000]
_cell_angle_beta [101.4990]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [SbAs2Cl]
_chemical_formula_sum '[Sb2 As4 Cl2]'
_cell_volume [199.1445]
_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  0.0000  0.0000  0.5000  1
  As  As1  4  0.2205  0.5000  0.6495  1
  Cl  Cl2  2  0.0000  0.5000  0.0000  1
]