data_[Na4Mn4Co2S12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Mn  1.5500  1.4000  0.6483
  Co  1.8800  1.3500  0.7683
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [5.9274]
_cell_length_b [10.2626]
_cell_length_c [6.9627]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.8526]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Na2Mn2CoS6]
_chemical_formula_sum '[Na4 Mn4 Co2 S12]'
_cell_volume [405.3521]
_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
[
  Na  Na0  4  0.0000  0.1677  0.0000  1.0
  Mn  Mn1  4  0.0000  0.3325  0.5000  1.0
  Co  Co2  2  0.0000  0.0000  0.5000  1.0
  S  S3  8  0.2271  0.1634  0.6860  1.0
  S  S4  4  0.2373  0.5000  0.6868  1.0
]