data_[Na2Pr2Mn2S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Na  0.9300  1.8000  1.1600
  Pr  1.1300  1.8500  1.0600
  Mn  1.5500  1.4000  0.6483
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [7.7262]
_cell_length_b [4.0763]
_cell_length_c [9.6908]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.3434]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [NaPrMnS3]
_chemical_formula_sum '[Na2 Pr2 Mn2 S6]'
_cell_volume [298.1504]
_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  2  0.2531  0.2500  0.7740  1
  Pr  Pr1  2  0.2975  0.7500  0.3704  1
  Mn  Mn2  2  0.0809  0.2500  0.1053  1
  S  S3  2  0.0350  0.2500  0.3341  1
  S  S4  2  0.2214  0.7500  0.0454  1
  S  S5  2  0.4552  0.7500  0.6588  1
]