data_[Ag4As4S10]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ag  1.9300  1.6000  1.0867
  As  2.1800  1.1500  0.6600
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [14.2221]
_cell_length_b [4.6966]
_cell_length_c [6.3368]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.2069]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Ag2As2S5]
_chemical_formula_sum '[Ag4 As4 S10]'
_cell_volume [416.5704]
_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
[
  Ag  Ag0  4  0.1706  0.5000  0.4445  1
  As  As1  4  0.1570  0.0000  0.9115  1
  S  S2  4  0.1272  0.0000  0.5532  1
  S  S3  4  0.1589  0.5000  0.0221  1
  S  S4  2  0.0000  0.0000  0.0000  1
]