data_[Rb2Tm2Ti2S8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rb  0.8200  2.3500  1.6600
  Tm  1.2500  1.7500  1.0950
  Ti  1.5400  1.4000  0.8517
  S  2.5800  1.0000  0.8800
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [6.5731]
_cell_length_b [6.8165]
_cell_length_c [9.1564]
_cell_angle_alpha [90.0000]
_cell_angle_beta [108.6029]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [RbTmTiS4]
_chemical_formula_sum '[Rb2 Tm2 Ti2 S8]'
_cell_volume [388.8250]
_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  0.2650  0.2500  0.0579  1.0
  Tm  Tm1  2  0.2059  0.2500  0.5442  1.0
  Ti  Ti2  2  0.2427  0.7500  0.3395  1.0
  S  S3  4  0.0009  0.5011  0.6930  1.0
  S  S4  2  0.4500  0.7500  0.1866  1.0
  S  S5  2  0.4635  0.7500  0.5784  1.0
]