data_[Rb2Mg2In2S6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Mg  1.3100  1.5000  0.8600
  In  1.7800  1.5500  0.9400
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.9396]
_cell_length_b [3.9268]
_cell_length_c [9.9188]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.6151]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [RbMgInS3]
_chemical_formula_sum '[Rb2 Mg2 In2 S6]'
_cell_volume [329.9753]
_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
[
  Rb  Rb0  2  0.2743  0.7500  0.7486  1
  Mg  Mg1  2  0.4025  0.7500  0.3880  1
  In  In2  2  0.1629  0.2500  0.1128  1
  S  S3  2  0.0191  0.2500  0.8429  1
  S  S4  2  0.3072  0.2500  0.4759  1
  S  S5  2  0.3668  0.7500  0.1335  1
]