data_[Mn2Ag4Sb2S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Mn  1.5500  1.4000  0.6483
  Ag  1.9300  1.6000  1.0867
  Sb  2.0500  1.4500  0.8300
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [8.6486]
_cell_length_b [6.7904]
_cell_length_c [6.5474]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [MnAg2SbS4]
_chemical_formula_sum '[Mn2 Ag4 Sb2 S8]'
_cell_volume [384.5129]
_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
[
  Mn  Mn0  2  0.0000  0.1552  0.0040  1.0
  Ag  Ag1  4  0.2486  0.3179  0.5032  1.0
  Sb  Sb2  2  0.0000  0.7901  0.4807  1.0
  S  S3  4  0.2109  0.3205  0.8898  1.0
  S  S4  2  0.0000  0.1420  0.3656  1.0
  S  S5  2  0.0000  0.8401  0.8635  1.0
]