data_[Mn2Ag4Bi2S8]
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
  Bi  2.0200  1.6000  1.0350
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [Pmn2_1]
_cell_length_a [8.5087]
_cell_length_b [6.9732]
_cell_length_c [6.6958]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [31]
_chemical_formula_structural [MnAg2BiS4]
_chemical_formula_sum '[Mn2 Ag4 Bi2 S8]'
_cell_volume [397.2783]
_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  0.6744  0.0033  1.0
  Ag  Ag1  4  0.2499  0.1808  0.0008  1.0
  Bi  Bi2  2  0.0000  0.3094  0.4943  1.0
  S  S3  4  0.2121  0.8340  0.8786  1.0
  S  S4  2  0.0000  0.3603  0.8905  1.0
  S  S5  2  0.0000  0.6629  0.3530  1.0
]